5-cyclopentyl-N-(4-methylphenyl)-4,6-dihydrothieno[2,3-c]pyrrole-2-carboxamide

C19H22N2OS — CID 53171174

IUPAC5-cyclopentyl-N-(4-methylphenyl)-4,6-dihydrothieno[2,3-c]pyrrole-2-carboxamide
SMILESCc1ccc(NC(=O)c2cc3c(s2)CN(C2CCCC2)C3)cc1
InChIInChI=1S/C19H22N2OS/c1-13-6-8-15(9-7-13)20-19(22)17-10-14-11-21(12-18(14)23-17)16-4-2-3-5-16/h6-10,16H,2-5,11-12H2,1H3,(H,20,22)
InChIKeyFOCIPGSRPDUDJQ-UHFFFAOYSA-N
MW326.46 g/mol
LogP4.57
Rot. Bonds3

About 5-cyclopentyl-N-(4-methylphenyl)-4,6-dihydrothieno[2,3-c]pyrrole-2-carboxamide

5-cyclopentyl-N-(4-methylphenyl)-4,6-dihydrothieno[2,3-c]pyrrole-2-carboxamide (PubChem CID 53171174) has the molecular formula C19H22N2OS and a molecular weight of 326.46 g/mol. Its IUPAC name is 5-cyclopentyl-N-(4-methylphenyl)-4,6-dihydrothieno[2,3-c]pyrrole-2-carboxamide.

Molecular Properties

Compound Name5-cyclopentyl-N-(4-methylphenyl)-4,6-dihydrothieno[2,3-c]pyrrole-2-carboxamide
PubChem CID53171174
Molecular FormulaC19H22N2OS
Molecular Weight326.46 g/mol
Exact Mass326.15
IUPAC Name5-cyclopentyl-N-(4-methylphenyl)-4,6-dihydrothieno[2,3-c]pyrrole-2-carboxamide
SMILESCc1ccc(NC(=O)c2cc3c(s2)CN(C2CCCC2)C3)cc1
InChIInChI=1S/C19H22N2OS/c1-13-6-8-15(9-7-13)20-19(22)17-10-14-11-21(12-18(14)23-17)16-4-2-3-5-16/h6-10,16H,2-5,11-12H2,1H3,(H,20,22)
InChIKeyFOCIPGSRPDUDJQ-UHFFFAOYSA-N
XLogP4.57
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.46
LogP ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-cyclopentyl-4,6-dihydrothieno[2,3-c]pyrrole-2-carboxylic acid
CID 83290816
5-cyclopentyl-N-[1-(3,4-dimethoxyphenyl)ethyl]-4,6-dihydrothieno[2,3-c]pyrrole-2-carboxamide
CID 53171233
5-cyclopentyl-N-(3-piperidin-1-ylpropyl)-4,6-dihydrothieno[2,3-c]pyrrole-2-carboxamide
CID 53171311
2-N-hydroxy-6-N-(4-methylphenyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-2,6-dicarboxamide
CID 90733683
1-(4-methylphenyl)-3-(4,5,6,7-tetrahydro-1-benzothiophene-2-carbonylamino)urea
CID 17268199
5-cyclopropyl-N-[1-(2,5-dimethoxyphenyl)ethyl]-4,6-dihydrothieno[2,3-c]pyrrole-2-carboxamide
CID 53171137
N-[4-[2-(methylamino)-2-oxoethyl]phenyl]-5,6-dihydro-4H-cyclopenta[b]thiophene-2-carboxamide
CID 37438512
(5S)-N-(4-bromophenyl)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide
CID 7946283
(5R)-N-(4-tert-butylphenyl)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide
CID 7914040
N-[4-(2-methylpropanoylamino)phenyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide
CID 26286826
N-(4-methylsulfanylphenyl)-5,6-dihydro-4H-cyclopenta[b]thiophene-2-carboxamide
CID 9153937
5-ethyl-4-methyl-N-(4-methylphenyl)thiophene-2-carboxamide
CID 7733711

Frequently Asked Questions

What is the IUPAC name of 5-cyclopentyl-N-(4-methylphenyl)-4,6-dihydrothieno[2,3-c]pyrrole-2-carboxamide?
The IUPAC name of 5-cyclopentyl-N-(4-methylphenyl)-4,6-dihydrothieno[2,3-c]pyrrole-2-carboxamide (CID 53171174) is 5-cyclopentyl-N-(4-methylphenyl)-4,6-dihydrothieno[2,3-c]pyrrole-2-carboxamide.
What is the SMILES notation for 5-cyclopentyl-N-(4-methylphenyl)-4,6-dihydrothieno[2,3-c]pyrrole-2-carboxamide?
The canonical SMILES for 5-cyclopentyl-N-(4-methylphenyl)-4,6-dihydrothieno[2,3-c]pyrrole-2-carboxamide is Cc1ccc(NC(=O)c2cc3c(s2)CN(C2CCCC2)C3)cc1.
What is the InChIKey of 5-cyclopentyl-N-(4-methylphenyl)-4,6-dihydrothieno[2,3-c]pyrrole-2-carboxamide?
The InChIKey is FOCIPGSRPDUDJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2OS/c1-13-6-8-15(9-7-13)20-19(22)17-10-14-11-21(12-18(14)23-17)16-4-2-3-5-16/h6-10,16H,2-5,11-12H2,1H3,(H,20,22).
What are the key properties of 5-cyclopentyl-N-(4-methylphenyl)-4,6-dihydrothieno[2,3-c]pyrrole-2-carboxamide?
5-cyclopentyl-N-(4-methylphenyl)-4,6-dihydrothieno[2,3-c]pyrrole-2-carboxamide has a molecular weight of 326.46 g/mol, XLogP of 4.57, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopentyl-N-(4-methylphenyl)-4,6-dihydrothieno[2,3-c]pyrrole-2-carboxamide is sourced from PubChem (CID 53171174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).