6-amino-7-(6-chloroimidazo[1,5-a]pyridin-5-yl)-2-methylpyrrolo[2,3-d]pyrimidine-5-carboxamide

C15H12ClN7O — CID 177026995

IUPAC6-amino-7-(6-chloroimidazo[1,5-a]pyridin-5-yl)-2-methylpyrrolo[2,3-d]pyrimidine-5-carboxamide
SMILESCc1ncc2c(C(N)=O)c(N)n(-c3c(Cl)ccc4cncn34)c2n1
InChIInChI=1S/C15H12ClN7O/c1-7-20-5-9-11(13(18)24)12(17)23(14(9)21-7)15-10(16)3-2-8-4-19-6-22(8)15/h2-6H,17H2,1H3,(H2,18,24)
InChIKeyAUJQUZBYUWSYGF-UHFFFAOYSA-N
MW341.76 g/mol
LogP1.71
Rot. Bonds2

About 6-amino-7-(6-chloroimidazo[1,5-a]pyridin-5-yl)-2-methylpyrrolo[2,3-d]pyrimidine-5-carboxamide

6-amino-7-(6-chloroimidazo[1,5-a]pyridin-5-yl)-2-methylpyrrolo[2,3-d]pyrimidine-5-carboxamide (PubChem CID 177026995) has the molecular formula C15H12ClN7O and a molecular weight of 341.76 g/mol. Its IUPAC name is 6-amino-7-(6-chloroimidazo[1,5-a]pyridin-5-yl)-2-methylpyrrolo[2,3-d]pyrimidine-5-carboxamide.

Molecular Properties

Compound Name6-amino-7-(6-chloroimidazo[1,5-a]pyridin-5-yl)-2-methylpyrrolo[2,3-d]pyrimidine-5-carboxamide
PubChem CID177026995
Molecular FormulaC15H12ClN7O
Molecular Weight341.76 g/mol
Exact Mass341.08
IUPAC Name6-amino-7-(6-chloroimidazo[1,5-a]pyridin-5-yl)-2-methylpyrrolo[2,3-d]pyrimidine-5-carboxamide
SMILESCc1ncc2c(C(N)=O)c(N)n(-c3c(Cl)ccc4cncn34)c2n1
InChIInChI=1S/C15H12ClN7O/c1-7-20-5-9-11(13(18)24)12(17)23(14(9)21-7)15-10(16)3-2-8-4-19-6-22(8)15/h2-6H,17H2,1H3,(H2,18,24)
InChIKeyAUJQUZBYUWSYGF-UHFFFAOYSA-N
XLogP1.71
TPSA117.12 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.76
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

6-amino-2-methyl-7-(2-methylimidazo[5,1-b][1,3]thiazol-3-yl)pyrrolo[2,3-d]pyrimidine-5-carboxamide
CID 177026966
6-amino-2-methyl-7-(1,3,5-trimethyl-2-oxo-4-pyridinyl)pyrrolo[2,3-d]pyrimidine-5-carboxamide
CID 172625947
5-methylimidazo[1,5-a]pyridine-6-carboxamide
CID 130637806
6-amino-2-ethyl-7-(3-hydroxy-2,6-dimethylphenyl)pyrrolo[2,3-d]pyrimidine-5-carboxamide
CID 171633879
11-amino-12-(6-chloro-3-hydroxy-2-methylphenyl)-7-methyl-3,5,6,12-tetrazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,10-pentaene-10-carboxamide
CID 172622342
6-chloroimidazo[1,5-a]pyridine-5-carbaldehyde
CID 122609401
(3aR,6aR)-5-(6-chloroimidazo[1,5-a]pyridin-5-yl)-2,3,3a,4,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-5-ol
CID 155631303
7-(2,5-dichlorophenyl)-2-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 14501858
5-methylimidazo[1,5-c]pyrimidine
CID 130250786
2-amino-5-chloro-1-(4,6-dimethyl-1,3-benzodioxol-5-yl)pyrrolo[2,3-b]pyridine-3-carboxamide
CID 170638163
potassium;2-amino-1-(3-hydroxy-2,6-dimethylphenyl)-7-methanidyl-6-(methylamino)pyrrolo[3,2-c]pyridine-3-carboxamide;carbanide
CID 178110771
3-(7-amino-6-carbamoyl-2-chloro-5-oxopyrido[2,3-d]pyrimidin-8-yl)propylcarbamic acid
CID 89106713

Frequently Asked Questions

What is the IUPAC name of 6-amino-7-(6-chloroimidazo[1,5-a]pyridin-5-yl)-2-methylpyrrolo[2,3-d]pyrimidine-5-carboxamide?
The IUPAC name of 6-amino-7-(6-chloroimidazo[1,5-a]pyridin-5-yl)-2-methylpyrrolo[2,3-d]pyrimidine-5-carboxamide (CID 177026995) is 6-amino-7-(6-chloroimidazo[1,5-a]pyridin-5-yl)-2-methylpyrrolo[2,3-d]pyrimidine-5-carboxamide.
What is the SMILES notation for 6-amino-7-(6-chloroimidazo[1,5-a]pyridin-5-yl)-2-methylpyrrolo[2,3-d]pyrimidine-5-carboxamide?
The canonical SMILES for 6-amino-7-(6-chloroimidazo[1,5-a]pyridin-5-yl)-2-methylpyrrolo[2,3-d]pyrimidine-5-carboxamide is Cc1ncc2c(C(N)=O)c(N)n(-c3c(Cl)ccc4cncn34)c2n1.
What is the InChIKey of 6-amino-7-(6-chloroimidazo[1,5-a]pyridin-5-yl)-2-methylpyrrolo[2,3-d]pyrimidine-5-carboxamide?
The InChIKey is AUJQUZBYUWSYGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClN7O/c1-7-20-5-9-11(13(18)24)12(17)23(14(9)21-7)15-10(16)3-2-8-4-19-6-22(8)15/h2-6H,17H2,1H3,(H2,18,24).
What are the key properties of 6-amino-7-(6-chloroimidazo[1,5-a]pyridin-5-yl)-2-methylpyrrolo[2,3-d]pyrimidine-5-carboxamide?
6-amino-7-(6-chloroimidazo[1,5-a]pyridin-5-yl)-2-methylpyrrolo[2,3-d]pyrimidine-5-carboxamide has a molecular weight of 341.76 g/mol, XLogP of 1.71, 2 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-7-(6-chloroimidazo[1,5-a]pyridin-5-yl)-2-methylpyrrolo[2,3-d]pyrimidine-5-carboxamide is sourced from PubChem (CID 177026995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).