2-(3-chloro-4-pyridinyl)-5-methyl-1H-pyrrolo[3,2-b]pyridine

C13H10ClN3 — CID 141247128

IUPAC2-(3-chloro-4-pyridinyl)-5-methyl-1H-pyrrolo[3,2-b]pyridine
SMILESCc1ccc2[nH]c(-c3ccncc3Cl)cc2n1
InChIInChI=1S/C13H10ClN3/c1-8-2-3-11-13(16-8)6-12(17-11)9-4-5-15-7-10(9)14/h2-7,17H,1H3
InChIKeyLNPCHWGXOACDKC-UHFFFAOYSA-N
MW243.70 g/mol
LogP3.59
Rot. Bonds1

About 2-(3-chloro-4-pyridinyl)-5-methyl-1H-pyrrolo[3,2-b]pyridine

2-(3-chloro-4-pyridinyl)-5-methyl-1H-pyrrolo[3,2-b]pyridine (PubChem CID 141247128) has the molecular formula C13H10ClN3 and a molecular weight of 243.70 g/mol. Its IUPAC name is 2-(3-chloro-4-pyridinyl)-5-methyl-1H-pyrrolo[3,2-b]pyridine.

Molecular Properties

Compound Name2-(3-chloro-4-pyridinyl)-5-methyl-1H-pyrrolo[3,2-b]pyridine
PubChem CID141247128
Molecular FormulaC13H10ClN3
Molecular Weight243.70 g/mol
Exact Mass243.06
IUPAC Name2-(3-chloro-4-pyridinyl)-5-methyl-1H-pyrrolo[3,2-b]pyridine
SMILESCc1ccc2[nH]c(-c3ccncc3Cl)cc2n1
InChIInChI=1S/C13H10ClN3/c1-8-2-3-11-13(16-8)6-12(17-11)9-4-5-15-7-10(9)14/h2-7,17H,1H3
InChIKeyLNPCHWGXOACDKC-UHFFFAOYSA-N
XLogP3.59
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.70
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[2-(3-chloro-4-pyridinyl)-1H-indol-5-yl]propanoic acid
CID 164627496
2-chloro-6-methyl-3-(3-methyl-4-pyridinyl)pyridine
CID 175089483
butane;2-methyl-1,6-naphthyridine
CID 142826315
6-chloro-2-(3-methoxy-4-pyridinyl)-5-(trifluoromethyl)-1H-indole
CID 141247106
ethane;methane;2-methyl-1,7-naphthyridine
CID 144748838
5-(3-chloro-4-pyridinyl)-2-methylquinolin-3-ol
CID 166359968
2-(4-chloro-3-pyridinyl)-1H-benzimidazole
CID 67996480
2-(2,4-dichlorophenyl)-5-methyl-1H-indole
CID 131886780
6-chloro-2-[2-(3-chloro-4-pyridinyl)-3-pyridinyl]-1H-benzimidazole
CID 58038261
2-(2-chloro-4-fluorophenyl)-5-methyl-1H-imidazo[4,5-b]pyridine
CID 81137815
4-bromo-2-(3-chloro-4-pyridinyl)-1H-benzimidazole
CID 114271455
6-chloro-5-methyl-2-pyridin-3-yl-1H-indole
CID 69096955

Frequently Asked Questions

What is the IUPAC name of 2-(3-chloro-4-pyridinyl)-5-methyl-1H-pyrrolo[3,2-b]pyridine?
The IUPAC name of 2-(3-chloro-4-pyridinyl)-5-methyl-1H-pyrrolo[3,2-b]pyridine (CID 141247128) is 2-(3-chloro-4-pyridinyl)-5-methyl-1H-pyrrolo[3,2-b]pyridine.
What is the SMILES notation for 2-(3-chloro-4-pyridinyl)-5-methyl-1H-pyrrolo[3,2-b]pyridine?
The canonical SMILES for 2-(3-chloro-4-pyridinyl)-5-methyl-1H-pyrrolo[3,2-b]pyridine is Cc1ccc2[nH]c(-c3ccncc3Cl)cc2n1.
What is the InChIKey of 2-(3-chloro-4-pyridinyl)-5-methyl-1H-pyrrolo[3,2-b]pyridine?
The InChIKey is LNPCHWGXOACDKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10ClN3/c1-8-2-3-11-13(16-8)6-12(17-11)9-4-5-15-7-10(9)14/h2-7,17H,1H3.
What are the key properties of 2-(3-chloro-4-pyridinyl)-5-methyl-1H-pyrrolo[3,2-b]pyridine?
2-(3-chloro-4-pyridinyl)-5-methyl-1H-pyrrolo[3,2-b]pyridine has a molecular weight of 243.70 g/mol, XLogP of 3.59, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chloro-4-pyridinyl)-5-methyl-1H-pyrrolo[3,2-b]pyridine is sourced from PubChem (CID 141247128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).