5-chloro-4-(6-methoxy-3-pyridinyl)-3-(2-methyl-7H-purin-6-yl)pyridin-2-amine

C17H14ClN7O — CID 142788955

IUPAC5-chloro-4-(6-methoxy-3-pyridinyl)-3-(2-methyl-7H-purin-6-yl)pyridin-2-amine
SMILESCOc1ccc(-c2c(Cl)cnc(N)c2-c2nc(C)nc3nc[nH]c23)cn1
InChIInChI=1S/C17H14ClN7O/c1-8-24-14(15-17(25-8)23-7-22-15)13-12(10(18)6-21-16(13)19)9-3-4-11(26-2)20-5-9/h3-7H,1-2H3,(H2,19,21)(H,22,23,24,25)
InChIKeyKVAFLAISCNXBSH-UHFFFAOYSA-N
MW367.80 g/mol
LogP3.03
Rot. Bonds3

About 5-chloro-4-(6-methoxy-3-pyridinyl)-3-(2-methyl-7H-purin-6-yl)pyridin-2-amine

5-chloro-4-(6-methoxy-3-pyridinyl)-3-(2-methyl-7H-purin-6-yl)pyridin-2-amine (PubChem CID 142788955) has the molecular formula C17H14ClN7O and a molecular weight of 367.80 g/mol. Its IUPAC name is 5-chloro-4-(6-methoxy-3-pyridinyl)-3-(2-methyl-7H-purin-6-yl)pyridin-2-amine.

Molecular Properties

Compound Name5-chloro-4-(6-methoxy-3-pyridinyl)-3-(2-methyl-7H-purin-6-yl)pyridin-2-amine
PubChem CID142788955
Molecular FormulaC17H14ClN7O
Molecular Weight367.80 g/mol
Exact Mass367.09
IUPAC Name5-chloro-4-(6-methoxy-3-pyridinyl)-3-(2-methyl-7H-purin-6-yl)pyridin-2-amine
SMILESCOc1ccc(-c2c(Cl)cnc(N)c2-c2nc(C)nc3nc[nH]c23)cn1
InChIInChI=1S/C17H14ClN7O/c1-8-24-14(15-17(25-8)23-7-22-15)13-12(10(18)6-21-16(13)19)9-3-4-11(26-2)20-5-9/h3-7H,1-2H3,(H2,19,21)(H,22,23,24,25)
InChIKeyKVAFLAISCNXBSH-UHFFFAOYSA-N
XLogP3.03
TPSA115.49 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.80
LogP ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 5-chloro-4-(6-methoxy-3-pyridinyl)-3-(2-methyl-7H-purin-6-yl)pyridin-2-amine with MolForge

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

Launch Full Analysis

Related Compounds

5-chloro-4-(6-methoxy-3-pyridinyl)-3-[2-methyl-9-(oxan-2-yl)purin-6-yl]pyridin-2-amine
CID 142788989
3,5-dichloro-4-(6-methoxy-3-pyridinyl)aniline
CID 90390971
2-chloro-6-(6-methoxy-3-pyridinyl)-5-(4-methyl-6-methylsulfanyl-1,3,5-triazin-2-yl)pyrimidin-4-amine
CID 142788927
2-(6-methoxy-3-pyridinyl)-N-phenyl-7H-purin-6-amine
CID 117079759
2-chloro-5-iodo-6-(6-methoxy-3-pyridinyl)pyrimidin-4-amine
CID 142788951
6-(2-methoxy-4-pyridinyl)-7H-purin-2-amine
CID 114052406
4-(6-methoxy-3-pyridinyl)-5-methyl-1H-pyrimidin-6-one
CID 136692328
(1R)-1-[6-[(6-methoxy-3-pyridinyl)amino]-5-(2-methyl-7H-purin-6-yl)-3-pyridinyl]-2,2-dimethylpropan-1-ol
CID 59548203
chloromercury;2-methoxy-7H-purin-6-amine
CID 69287233
(3R)-1-[6-[(6-methoxy-3-pyridinyl)amino]-5-(2-methyl-7H-purin-6-yl)-3-pyridinyl]pyrrolidin-3-ol
CID 59548314
1-[3,5-dichloro-4-(6-methoxy-3-pyridinyl)phenyl]-1,2,4-triazole-3,5-diamine
CID 118590880
2-(6-methoxy-3-pyridinyl)-N-(4-phenoxyphenyl)-7H-purin-6-amine
CID 117084081

Frequently Asked Questions

What is the IUPAC name of 5-chloro-4-(6-methoxy-3-pyridinyl)-3-(2-methyl-7H-purin-6-yl)pyridin-2-amine?
The IUPAC name of 5-chloro-4-(6-methoxy-3-pyridinyl)-3-(2-methyl-7H-purin-6-yl)pyridin-2-amine (CID 142788955) is 5-chloro-4-(6-methoxy-3-pyridinyl)-3-(2-methyl-7H-purin-6-yl)pyridin-2-amine.
What is the SMILES notation for 5-chloro-4-(6-methoxy-3-pyridinyl)-3-(2-methyl-7H-purin-6-yl)pyridin-2-amine?
The canonical SMILES for 5-chloro-4-(6-methoxy-3-pyridinyl)-3-(2-methyl-7H-purin-6-yl)pyridin-2-amine is COc1ccc(-c2c(Cl)cnc(N)c2-c2nc(C)nc3nc[nH]c23)cn1.
What is the InChIKey of 5-chloro-4-(6-methoxy-3-pyridinyl)-3-(2-methyl-7H-purin-6-yl)pyridin-2-amine?
The InChIKey is KVAFLAISCNXBSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14ClN7O/c1-8-24-14(15-17(25-8)23-7-22-15)13-12(10(18)6-21-16(13)19)9-3-4-11(26-2)20-5-9/h3-7H,1-2H3,(H2,19,21)(H,22,23,24,25).
What are the key properties of 5-chloro-4-(6-methoxy-3-pyridinyl)-3-(2-methyl-7H-purin-6-yl)pyridin-2-amine?
5-chloro-4-(6-methoxy-3-pyridinyl)-3-(2-methyl-7H-purin-6-yl)pyridin-2-amine has a molecular weight of 367.80 g/mol, XLogP of 3.03, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-4-(6-methoxy-3-pyridinyl)-3-(2-methyl-7H-purin-6-yl)pyridin-2-amine is sourced from PubChem (CID 142788955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).