2-Methyl-2-(pyridin-4-ylmethylamino)propan-1-ol
Basic information
- CAS
869942-15-4- Standard SMILES
CC(C)(CO)NCc1ccncc1- InChIKey
TZDUZQUTTIZESH-UHFFFAOYSA-N- Molecular formula
- C10H16N2O
- Average molar mass
- 180.25 g/mol
- Monoisotopic mass
- 180.12626314
Names & identifiers
- Preferred name
- 2-Methyl-2-(pyridin-4-ylmethylamino)propan-1-ol
- IUPAC
- 2-methyl-2-(pyridin-4-ylmethylamino)propan-1-ol
- English name
- 2-methyl-2-[(pyridin-4-ylmethyl)amino]propan-1-ol
- Molecular formula
- C10H16N2O
- Molecular weight
- 180.25
Names & synonyms
869942-15-42-Methyl-2-((pyridin-4-ylmethyl)amino)propan-1-ol2-methyl-2-(pyridin-4-ylmethylamino)propan-1-ol2-METHYL-2-[(4-PYRIDINYLMETHYL)AMINO]-1-PROPANOL2-methyl-2-{[(pyridin-4-yl)methyl]amino}propan-1-olDTXSID70405866AKOS002614072SB538212-methyl-2-(4-pyridylmethylamino)propan-1-olEN300-167312UKRORGSYN-BB BBV-1769832-methyl-2-[(pyridin-4-ylmethyl)amino]propan-1-ol
Show more names
1-Propanol, 2-methyl-2-[(4-pyridinylmethyl)amino]-2-methyl-2-[(4-pyridinylmethyl)amino]-1-propanol(SALTDATA: HCl)
Database identifiers
- CAS
869942-15-4- PubChem CID
- 4715445
- DTXSID
DTXSID70405866
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 45.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 142
Physicochemical properties
- Boiling point
- 325.6 · 325.6±22.0 °C(Predicted)
- Density
- 1.051 · 1.051±0.06 g/cm3(Predicted)
- pka
- 15.48 · 15.48±0.10(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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