Basic information
- CAS
1224879-47-3- Standard SMILES
O=C(NCC1CCNCC1)c1ccc(O)c2[nH]c(C3CC3)nc12- InChIKey
FOPKNXVYPWDCPH-UHFFFAOYSA-N- Molecular formula
- C17H22N4O2
- Average molar mass
- 314.4 g/mol
- Monoisotopic mass
- 314.17427596
Names & identifiers
- Preferred name
- 2-Cyclopropyl-7-hydroxy-N-(4-piperidinylmethyl)-1H-benzimidazole-4-carboxamide
- IUPAC
- 2-cyclopropyl-7-hydroxy-N-(piperidin-4-ylmethyl)-1H-benzimidazole-4-carboxamide
Names & synonyms
SCHEMBL2331220CHEMBL3718092SCHEMBL12259882FOPKNXVYPWDCPH-UHFFFAOYSA-NDTXSID0011385652-Cyclopropyl-7-hydroxy-N-(4-piperidinylmethyl)-1H-benzimidazole-4-carboxamide1224879-47-32-cyclopropyl-4-hydroxy-n-(piperidin-4-ylmethyl)-1h-benzo[d]imidazole-7-carboxamide2-Cyclopropyl-4-hydroxy-N-[(piperidin-4-yl)methyl]-1H-benzimidazole-7-carboxamide
Database identifiers
- CAS
1224879-47-3- PubChem CID
- 46190861
- DTXSID
DTXSID001138565- ChEMBL
CHEMBL3718092
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 90 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 436
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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