Basic information
- CAS
302900-97-6- Standard SMILES
COc1ccccc1N1CCN(CC(C)N(C(=O)C2CCCCC2)c2ccccn2)CC1- InChIKey
MDUDKPOIYPKKNF-UHFFFAOYSA-N- Molecular formula
- C26H36N4O2
- Average molar mass
- 436.6 g/mol
- Monoisotopic mass
- 436.2838264
Names & identifiers
- Preferred name
- N-{1-[4-(2-methoxyphenyl)piperazin-1-yl]propan-2-yl}-N-(pyridin-2-yl)cyclohexanecarboxamide
- IUPAC
- N-[1-[4-(2-methoxyphenyl)piperazin-1-yl]propan-2-yl]-N-pyridin-2-ylcyclohexanecarboxamide
- English name
- N-[2-[4-(2-Methoxyphenyl)piperazino]-1-methylethyl]-N-pyridin-2-ylcyclohexanecarboxamide
- Molecular formula
- C26H36N4O2
- Molecular weight
- 436.59
Names & synonyms
302900-97-6N-{1-[4-(2-methoxyphenyl)piperazin-1-yl]propan-2-yl}-N-(pyridin-2-yl)cyclohexanecarboxamideN-[2-[4-(2-methoxyphenyl)piperazino]-1-methylethyl]-N-pyridin-2-ylcyclohexanecarboxamideN-[1-[4-(2-methoxyphenyl)piperazin-1-yl]propan-2-yl]-N-pyridin-2-ylcyclohexanecarboxamideN-{2-[4-(2-methoxyphenyl)piperazino]-1-methylethyl}-N-pyridin-2-ylcyclohexanecarboxamideCyclohexanecarboxamide, N-[2-[4-(2-methoxyphenyl)-1-piperazinyl]-1-methylethyl]-N-2-pyridinyl-Maybridge1_006646Oprea1_364450MLS001182203SCHEMBL7474356CHEMBL1393030HMS560G02
Show more names
N-[2-[4-(2-METHOXYPHENYL)PIPERIZINO]-1-METHYLETHYL]-N-PYRID-2-YLCYCLOHEXANECARBOXAMIDE
DTXSID70346109MDUDKPOIYPKKNF-UHFFFAOYSA-NHMS2859A13MFCD01566906CCG-247412SMR000567881DB-068260NS00096902
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 48.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 574
Physicochemical properties
- Melting point
- 90 °C · 90 °C
- Boiling point
- 599.6 · 599.6±50.0 °C(Predicted)
- Density
- 1.139 · 1.139±0.06 g/cm3(Predicted)
- pka
- 7.03 · 7.03±0.10(Predicted)
- Hazard Codes
- Xi
- Hazard Note
- Irritant
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hazard_code
- Xi
- hazard_note
- Irritant
Chemistry & industry
Suppliers2 total
济南思考化学有限公司0531-0000 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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