[3-(3-chlorophenyl)imidazo[4,5-b]pyridin-6-yl]-piperidin-1-ylmethanone

C18H17ClN4O — CID 156811401

IUPAC[3-(3-chlorophenyl)imidazo[4,5-b]pyridin-6-yl]-piperidin-1-ylmethanone
SMILESO=C(c1cnc2c(c1)ncn2-c1cccc(Cl)c1)N1CCCCC1
InChIInChI=1S/C18H17ClN4O/c19-14-5-4-6-15(10-14)23-12-21-16-9-13(11-20-17(16)23)18(24)22-7-2-1-3-8-22/h4-6,9-12H,1-3,7-8H2
InChIKeyKTONNYCAHQNBMN-UHFFFAOYSA-N
MW340.81 g/mol
LogP3.70
Rot. Bonds2

About [3-(3-chlorophenyl)imidazo[4,5-b]pyridin-6-yl]-piperidin-1-ylmethanone

[3-(3-chlorophenyl)imidazo[4,5-b]pyridin-6-yl]-piperidin-1-ylmethanone (PubChem CID 156811401) has the molecular formula C18H17ClN4O and a molecular weight of 340.81 g/mol. Its IUPAC name is [3-(3-chlorophenyl)imidazo[4,5-b]pyridin-6-yl]-piperidin-1-ylmethanone.

Molecular Properties

Compound Name[3-(3-chlorophenyl)imidazo[4,5-b]pyridin-6-yl]-piperidin-1-ylmethanone
PubChem CID156811401
Molecular FormulaC18H17ClN4O
Molecular Weight340.81 g/mol
Exact Mass340.11
IUPAC Name[3-(3-chlorophenyl)imidazo[4,5-b]pyridin-6-yl]-piperidin-1-ylmethanone
SMILESO=C(c1cnc2c(c1)ncn2-c1cccc(Cl)c1)N1CCCCC1
InChIInChI=1S/C18H17ClN4O/c19-14-5-4-6-15(10-14)23-12-21-16-9-13(11-20-17(16)23)18(24)22-7-2-1-3-8-22/h4-6,9-12H,1-3,7-8H2
InChIKeyKTONNYCAHQNBMN-UHFFFAOYSA-N
XLogP3.70
TPSA51.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.81
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze [3-(3-chlorophenyl)imidazo[4,5-b]pyridin-6-yl]-piperidin-1-ylmethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [3-(3-chlorophenyl)imidazo[4,5-b]pyridin-6-yl]-piperidin-1-ylmethanone?
The IUPAC name of [3-(3-chlorophenyl)imidazo[4,5-b]pyridin-6-yl]-piperidin-1-ylmethanone (CID 156811401) is [3-(3-chlorophenyl)imidazo[4,5-b]pyridin-6-yl]-piperidin-1-ylmethanone.
What is the SMILES notation for [3-(3-chlorophenyl)imidazo[4,5-b]pyridin-6-yl]-piperidin-1-ylmethanone?
The canonical SMILES for [3-(3-chlorophenyl)imidazo[4,5-b]pyridin-6-yl]-piperidin-1-ylmethanone is O=C(c1cnc2c(c1)ncn2-c1cccc(Cl)c1)N1CCCCC1.
What is the InChIKey of [3-(3-chlorophenyl)imidazo[4,5-b]pyridin-6-yl]-piperidin-1-ylmethanone?
The InChIKey is KTONNYCAHQNBMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17ClN4O/c19-14-5-4-6-15(10-14)23-12-21-16-9-13(11-20-17(16)23)18(24)22-7-2-1-3-8-22/h4-6,9-12H,1-3,7-8H2.
What are the key properties of [3-(3-chlorophenyl)imidazo[4,5-b]pyridin-6-yl]-piperidin-1-ylmethanone?
[3-(3-chlorophenyl)imidazo[4,5-b]pyridin-6-yl]-piperidin-1-ylmethanone has a molecular weight of 340.81 g/mol, XLogP of 3.70, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(3-chlorophenyl)imidazo[4,5-b]pyridin-6-yl]-piperidin-1-ylmethanone is sourced from PubChem (CID 156811401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).