(2R)-N-(2-chlorophenyl)-2-imidazo[1,5-a]pyridin-3-ylsulfanylpropanamide

C16H14ClN3OS — CID 40792477

IUPAC(2R)-N-(2-chlorophenyl)-2-imidazo[1,5-a]pyridin-3-ylsulfanylpropanamide
SMILESC[C@@H](Sc1ncc2ccccn12)C(=O)Nc1ccccc1Cl
InChIInChI=1S/C16H14ClN3OS/c1-11(15(21)19-14-8-3-2-7-13(14)17)22-16-18-10-12-6-4-5-9-20(12)16/h2-11H,1H3,(H,19,21)/t11-/m1/s1
InChIKeyGLPOXWAQMCVBSX-LLVKDONJSA-N
MW331.83 g/mol
LogP4.11
Rot. Bonds4

About (2R)-N-(2-chlorophenyl)-2-imidazo[1,5-a]pyridin-3-ylsulfanylpropanamide

(2R)-N-(2-chlorophenyl)-2-imidazo[1,5-a]pyridin-3-ylsulfanylpropanamide (PubChem CID 40792477) has the molecular formula C16H14ClN3OS and a molecular weight of 331.83 g/mol. Its IUPAC name is (2R)-N-(2-chlorophenyl)-2-imidazo[1,5-a]pyridin-3-ylsulfanylpropanamide.

Molecular Properties

Compound Name(2R)-N-(2-chlorophenyl)-2-imidazo[1,5-a]pyridin-3-ylsulfanylpropanamide
PubChem CID40792477
Molecular FormulaC16H14ClN3OS
Molecular Weight331.83 g/mol
Exact Mass331.05
IUPAC Name(2R)-N-(2-chlorophenyl)-2-imidazo[1,5-a]pyridin-3-ylsulfanylpropanamide
SMILESC[C@@H](Sc1ncc2ccccn12)C(=O)Nc1ccccc1Cl
InChIInChI=1S/C16H14ClN3OS/c1-11(15(21)19-14-8-3-2-7-13(14)17)22-16-18-10-12-6-4-5-9-20(12)16/h2-11H,1H3,(H,19,21)/t11-/m1/s1
InChIKeyGLPOXWAQMCVBSX-LLVKDONJSA-N
XLogP4.11
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.83
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-imidazo[1,5-a]pyridin-3-ylsulfanyl-N-(2-nitrophenyl)propanamide
CID 46794291
(2R)-2-imidazo[1,5-a]pyridin-3-ylsulfanyl-N-(4-methoxyphenyl)propanamide
CID 27507079
(2S)-N-[4-(difluoromethoxy)phenyl]-2-imidazo[1,5-a]pyridin-3-ylsulfanylpropanamide
CID 25356249
(2R)-N-(tert-butylcarbamoyl)-2-imidazo[1,5-a]pyridin-3-ylsulfanylpropanamide
CID 27507138
N-[(2,4-dimethylphenyl)carbamoyl]-2-imidazo[1,5-a]pyridin-3-ylsulfanylpropanamide
CID 46529920
N-(3-chloro-2-methylphenyl)-2-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)propanamide
CID 46629612
N-[2-(2-ethylanilino)-2-oxoethyl]-2-imidazo[1,5-a]pyridin-3-ylsulfanyl-N-methylpropanamide
CID 42988681
(2S)-2-imidazo[1,5-a]pyridin-3-ylsulfanyl-N-[(1R)-1-phenylbutyl]propanamide
CID 39816503
N-(2-chlorophenyl)-2-(1-cyclohexyl-4,5-dimethylimidazol-2-yl)sulfanylpropanamide
CID 46625671
2-[(4-amino-5-propyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-chlorophenyl)propanamide
CID 20999977
N-(2-chlorophenyl)-2-[[5-(4-fluorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]propanamide
CID 78655227
(2R)-N-(2-chlorophenyl)-2-naphthalen-2-ylsulfanylpropanamide
CID 8957293

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(2-chlorophenyl)-2-imidazo[1,5-a]pyridin-3-ylsulfanylpropanamide?
The IUPAC name of (2R)-N-(2-chlorophenyl)-2-imidazo[1,5-a]pyridin-3-ylsulfanylpropanamide (CID 40792477) is (2R)-N-(2-chlorophenyl)-2-imidazo[1,5-a]pyridin-3-ylsulfanylpropanamide.
What is the SMILES notation for (2R)-N-(2-chlorophenyl)-2-imidazo[1,5-a]pyridin-3-ylsulfanylpropanamide?
The canonical SMILES for (2R)-N-(2-chlorophenyl)-2-imidazo[1,5-a]pyridin-3-ylsulfanylpropanamide is C[C@@H](Sc1ncc2ccccn12)C(=O)Nc1ccccc1Cl.
What is the InChIKey of (2R)-N-(2-chlorophenyl)-2-imidazo[1,5-a]pyridin-3-ylsulfanylpropanamide?
The InChIKey is GLPOXWAQMCVBSX-LLVKDONJSA-N. The full InChI is InChI=1S/C16H14ClN3OS/c1-11(15(21)19-14-8-3-2-7-13(14)17)22-16-18-10-12-6-4-5-9-20(12)16/h2-11H,1H3,(H,19,21)/t11-/m1/s1.
What are the key properties of (2R)-N-(2-chlorophenyl)-2-imidazo[1,5-a]pyridin-3-ylsulfanylpropanamide?
(2R)-N-(2-chlorophenyl)-2-imidazo[1,5-a]pyridin-3-ylsulfanylpropanamide has a molecular weight of 331.83 g/mol, XLogP of 4.11, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(2-chlorophenyl)-2-imidazo[1,5-a]pyridin-3-ylsulfanylpropanamide is sourced from PubChem (CID 40792477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).