N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2,3-dihydro-1-benzothiophene-2-carboxamide

C23H19N3OS — CID 55494966

IUPACN-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2,3-dihydro-1-benzothiophene-2-carboxamide
SMILESCc1cccn2c(NC(=O)C3Cc4ccccc4S3)c(-c3ccccc3)nc12
InChIInChI=1S/C23H19N3OS/c1-15-8-7-13-26-21(15)24-20(16-9-3-2-4-10-16)22(26)25-23(27)19-14-17-11-5-6-12-18(17)28-19/h2-13,19H,14H2,1H3,(H,25,27)
InChIKeyODQCYNIOIDTQNT-UHFFFAOYSA-N
MW385.49 g/mol
LogP4.97
Rot. Bonds3

About N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2,3-dihydro-1-benzothiophene-2-carboxamide

N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2,3-dihydro-1-benzothiophene-2-carboxamide (PubChem CID 55494966) has the molecular formula C23H19N3OS and a molecular weight of 385.49 g/mol. Its IUPAC name is N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2,3-dihydro-1-benzothiophene-2-carboxamide.

Molecular Properties

Compound NameN-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2,3-dihydro-1-benzothiophene-2-carboxamide
PubChem CID55494966
Molecular FormulaC23H19N3OS
Molecular Weight385.49 g/mol
Exact Mass385.12
IUPAC NameN-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2,3-dihydro-1-benzothiophene-2-carboxamide
SMILESCc1cccn2c(NC(=O)C3Cc4ccccc4S3)c(-c3ccccc3)nc12
InChIInChI=1S/C23H19N3OS/c1-15-8-7-13-26-21(15)24-20(16-9-3-2-4-10-16)22(26)25-23(27)19-14-17-11-5-6-12-18(17)28-19/h2-13,19H,14H2,1H3,(H,25,27)
InChIKeyODQCYNIOIDTQNT-UHFFFAOYSA-N
XLogP4.97
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.49
LogP ≤ 54.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)cyclohexanecarboxamide
CID 18282898
(3R)-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)oxolane-3-carboxamide
CID 95272020
(3S,7aR)-7a-methyl-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-5-oxo-2,3,6,7-tetrahydropyrrolo[2,1-b][1,3]thiazole-3-carboxamide
CID 51922958
ethyl (3S)-3-[(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)carbamoyl]piperidine-1-carboxylate
CID 51933788
3-cyclopentyl-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)propanamide
CID 16559332
5-methyl-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-1,2-oxazole-3-carboxamide
CID 60520237
N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-pyrimidin-2-yl-1,3-thiazole-4-carboxamide
CID 55874614
2-[(3aR,7aR)-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl]-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide
CID 92738385
N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-3-[(2R)-oxolan-2-yl]propanamide
CID 94092022
N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-4-oxo-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanamide
CID 55540978
N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-4-pyrrolidin-1-ylsulfonylbutanamide
CID 112844900
(2S)-N-(1-methylpyrazol-3-yl)-2,3-dihydro-1-benzothiophene-2-carboxamide
CID 94794619

Frequently Asked Questions

What is the IUPAC name of N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2,3-dihydro-1-benzothiophene-2-carboxamide?
The IUPAC name of N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2,3-dihydro-1-benzothiophene-2-carboxamide (CID 55494966) is N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2,3-dihydro-1-benzothiophene-2-carboxamide.
What is the SMILES notation for N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2,3-dihydro-1-benzothiophene-2-carboxamide?
The canonical SMILES for N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2,3-dihydro-1-benzothiophene-2-carboxamide is Cc1cccn2c(NC(=O)C3Cc4ccccc4S3)c(-c3ccccc3)nc12.
What is the InChIKey of N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2,3-dihydro-1-benzothiophene-2-carboxamide?
The InChIKey is ODQCYNIOIDTQNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N3OS/c1-15-8-7-13-26-21(15)24-20(16-9-3-2-4-10-16)22(26)25-23(27)19-14-17-11-5-6-12-18(17)28-19/h2-13,19H,14H2,1H3,(H,25,27).
What are the key properties of N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2,3-dihydro-1-benzothiophene-2-carboxamide?
N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2,3-dihydro-1-benzothiophene-2-carboxamide has a molecular weight of 385.49 g/mol, XLogP of 4.97, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2,3-dihydro-1-benzothiophene-2-carboxamide is sourced from PubChem (CID 55494966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).