3-[[(1-benzylimidazo[4,5-c]pyridin-4-yl)amino]methyl]cyclopentan-1-ol

C19H22N4O — CID 167991983

IUPAC3-[[(1-benzylimidazo[4,5-c]pyridin-4-yl)amino]methyl]cyclopentan-1-ol
SMILESOC1CCC(CNc2nccc3c2ncn3Cc2ccccc2)C1
InChIInChI=1S/C19H22N4O/c24-16-7-6-15(10-16)11-21-19-18-17(8-9-20-19)23(13-22-18)12-14-4-2-1-3-5-14/h1-5,8-9,13,15-16,24H,6-7,10-12H2,(H,20,21)
InChIKeyUXUSPOLZQBVFLA-UHFFFAOYSA-N
MW322.41 g/mol
LogP3.05
Rot. Bonds5

About 3-[[(1-benzylimidazo[4,5-c]pyridin-4-yl)amino]methyl]cyclopentan-1-ol

3-[[(1-benzylimidazo[4,5-c]pyridin-4-yl)amino]methyl]cyclopentan-1-ol (PubChem CID 167991983) has the molecular formula C19H22N4O and a molecular weight of 322.41 g/mol. Its IUPAC name is 3-[[(1-benzylimidazo[4,5-c]pyridin-4-yl)amino]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name3-[[(1-benzylimidazo[4,5-c]pyridin-4-yl)amino]methyl]cyclopentan-1-ol
PubChem CID167991983
Molecular FormulaC19H22N4O
Molecular Weight322.41 g/mol
Exact Mass322.18
IUPAC Name3-[[(1-benzylimidazo[4,5-c]pyridin-4-yl)amino]methyl]cyclopentan-1-ol
SMILESOC1CCC(CNc2nccc3c2ncn3Cc2ccccc2)C1
InChIInChI=1S/C19H22N4O/c24-16-7-6-15(10-16)11-21-19-18-17(8-9-20-19)23(13-22-18)12-14-4-2-1-3-5-14/h1-5,8-9,13,15-16,24H,6-7,10-12H2,(H,20,21)
InChIKeyUXUSPOLZQBVFLA-UHFFFAOYSA-N
XLogP3.05
TPSA62.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.41
LogP ≤ 53.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-[[(1-benzylimidazo[4,5-c]pyridin-4-yl)amino]methyl]cyclopentan-1-ol?
The IUPAC name of 3-[[(1-benzylimidazo[4,5-c]pyridin-4-yl)amino]methyl]cyclopentan-1-ol (CID 167991983) is 3-[[(1-benzylimidazo[4,5-c]pyridin-4-yl)amino]methyl]cyclopentan-1-ol.
What is the SMILES notation for 3-[[(1-benzylimidazo[4,5-c]pyridin-4-yl)amino]methyl]cyclopentan-1-ol?
The canonical SMILES for 3-[[(1-benzylimidazo[4,5-c]pyridin-4-yl)amino]methyl]cyclopentan-1-ol is OC1CCC(CNc2nccc3c2ncn3Cc2ccccc2)C1.
What is the InChIKey of 3-[[(1-benzylimidazo[4,5-c]pyridin-4-yl)amino]methyl]cyclopentan-1-ol?
The InChIKey is UXUSPOLZQBVFLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O/c24-16-7-6-15(10-16)11-21-19-18-17(8-9-20-19)23(13-22-18)12-14-4-2-1-3-5-14/h1-5,8-9,13,15-16,24H,6-7,10-12H2,(H,20,21).
What are the key properties of 3-[[(1-benzylimidazo[4,5-c]pyridin-4-yl)amino]methyl]cyclopentan-1-ol?
3-[[(1-benzylimidazo[4,5-c]pyridin-4-yl)amino]methyl]cyclopentan-1-ol has a molecular weight of 322.41 g/mol, XLogP of 3.05, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[(1-benzylimidazo[4,5-c]pyridin-4-yl)amino]methyl]cyclopentan-1-ol is sourced from PubChem (CID 167991983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).