6-chloro-2-(4-methoxyphenyl)-N-(1-methylpiperidin-4-yl)-1H-imidazo[4,5-b]pyridin-7-amine

C19H22ClN5O — CID 127041238

IUPAC6-chloro-2-(4-methoxyphenyl)-N-(1-methylpiperidin-4-yl)-1H-imidazo[4,5-b]pyridin-7-amine
SMILESCOc1ccc(-c2nc3ncc(Cl)c(NC4CCN(C)CC4)c3[nH]2)cc1
InChIInChI=1S/C19H22ClN5O/c1-25-9-7-13(8-10-25)22-16-15(20)11-21-19-17(16)23-18(24-19)12-3-5-14(26-2)6-4-12/h3-6,11,13H,7-10H2,1-2H3,(H2,21,22,23,24)
InChIKeyYCSYRANYCZGGLN-UHFFFAOYSA-N
MW371.87 g/mol
LogP3.79
Rot. Bonds4

About 6-chloro-2-(4-methoxyphenyl)-N-(1-methylpiperidin-4-yl)-1H-imidazo[4,5-b]pyridin-7-amine

6-chloro-2-(4-methoxyphenyl)-N-(1-methylpiperidin-4-yl)-1H-imidazo[4,5-b]pyridin-7-amine (PubChem CID 127041238) has the molecular formula C19H22ClN5O and a molecular weight of 371.87 g/mol. Its IUPAC name is 6-chloro-2-(4-methoxyphenyl)-N-(1-methylpiperidin-4-yl)-1H-imidazo[4,5-b]pyridin-7-amine.

Molecular Properties

Compound Name6-chloro-2-(4-methoxyphenyl)-N-(1-methylpiperidin-4-yl)-1H-imidazo[4,5-b]pyridin-7-amine
PubChem CID127041238
Molecular FormulaC19H22ClN5O
Molecular Weight371.87 g/mol
Exact Mass371.15
IUPAC Name6-chloro-2-(4-methoxyphenyl)-N-(1-methylpiperidin-4-yl)-1H-imidazo[4,5-b]pyridin-7-amine
SMILESCOc1ccc(-c2nc3ncc(Cl)c(NC4CCN(C)CC4)c3[nH]2)cc1
InChIInChI=1S/C19H22ClN5O/c1-25-9-7-13(8-10-25)22-16-15(20)11-21-19-17(16)23-18(24-19)12-3-5-14(26-2)6-4-12/h3-6,11,13H,7-10H2,1-2H3,(H2,21,22,23,24)
InChIKeyYCSYRANYCZGGLN-UHFFFAOYSA-N
XLogP3.79
TPSA66.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.87
LogP ≤ 53.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 6-chloro-2-(4-methoxyphenyl)-N-(1-methylpiperidin-4-yl)-1H-imidazo[4,5-b]pyridin-7-amine 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 6-chloro-2-(4-methoxyphenyl)-N-(1-methylpiperidin-4-yl)-1H-imidazo[4,5-b]pyridin-7-amine?
The IUPAC name of 6-chloro-2-(4-methoxyphenyl)-N-(1-methylpiperidin-4-yl)-1H-imidazo[4,5-b]pyridin-7-amine (CID 127041238) is 6-chloro-2-(4-methoxyphenyl)-N-(1-methylpiperidin-4-yl)-1H-imidazo[4,5-b]pyridin-7-amine.
What is the SMILES notation for 6-chloro-2-(4-methoxyphenyl)-N-(1-methylpiperidin-4-yl)-1H-imidazo[4,5-b]pyridin-7-amine?
The canonical SMILES for 6-chloro-2-(4-methoxyphenyl)-N-(1-methylpiperidin-4-yl)-1H-imidazo[4,5-b]pyridin-7-amine is COc1ccc(-c2nc3ncc(Cl)c(NC4CCN(C)CC4)c3[nH]2)cc1.
What is the InChIKey of 6-chloro-2-(4-methoxyphenyl)-N-(1-methylpiperidin-4-yl)-1H-imidazo[4,5-b]pyridin-7-amine?
The InChIKey is YCSYRANYCZGGLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22ClN5O/c1-25-9-7-13(8-10-25)22-16-15(20)11-21-19-17(16)23-18(24-19)12-3-5-14(26-2)6-4-12/h3-6,11,13H,7-10H2,1-2H3,(H2,21,22,23,24).
What are the key properties of 6-chloro-2-(4-methoxyphenyl)-N-(1-methylpiperidin-4-yl)-1H-imidazo[4,5-b]pyridin-7-amine?
6-chloro-2-(4-methoxyphenyl)-N-(1-methylpiperidin-4-yl)-1H-imidazo[4,5-b]pyridin-7-amine has a molecular weight of 371.87 g/mol, XLogP of 3.79, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-(4-methoxyphenyl)-N-(1-methylpiperidin-4-yl)-1H-imidazo[4,5-b]pyridin-7-amine is sourced from PubChem (CID 127041238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).