5-acetamido-N-[1-(hydroxymethyl)cyclopentyl]thiophene-2-carboxamide

C13H18N2O3S — CID 62525158

IUPAC5-acetamido-N-[1-(hydroxymethyl)cyclopentyl]thiophene-2-carboxamide
SMILESCC(=O)Nc1ccc(C(=O)NC2(CO)CCCC2)s1
InChIInChI=1S/C13H18N2O3S/c1-9(17)14-11-5-4-10(19-11)12(18)15-13(8-16)6-2-3-7-13/h4-5,16H,2-3,6-8H2,1H3,(H,14,17)(H,15,18)
InChIKeyPQDCQQPLFGSTHC-UHFFFAOYSA-N
MW282.36 g/mol
LogP1.74
Rot. Bonds4

About 5-acetamido-N-[1-(hydroxymethyl)cyclopentyl]thiophene-2-carboxamide

5-acetamido-N-[1-(hydroxymethyl)cyclopentyl]thiophene-2-carboxamide (PubChem CID 62525158) has the molecular formula C13H18N2O3S and a molecular weight of 282.36 g/mol. Its IUPAC name is 5-acetamido-N-[1-(hydroxymethyl)cyclopentyl]thiophene-2-carboxamide.

Molecular Properties

Compound Name5-acetamido-N-[1-(hydroxymethyl)cyclopentyl]thiophene-2-carboxamide
PubChem CID62525158
Molecular FormulaC13H18N2O3S
Molecular Weight282.36 g/mol
Exact Mass282.10
IUPAC Name5-acetamido-N-[1-(hydroxymethyl)cyclopentyl]thiophene-2-carboxamide
SMILESCC(=O)Nc1ccc(C(=O)NC2(CO)CCCC2)s1
InChIInChI=1S/C13H18N2O3S/c1-9(17)14-11-5-4-10(19-11)12(18)15-13(8-16)6-2-3-7-13/h4-5,16H,2-3,6-8H2,1H3,(H,14,17)(H,15,18)
InChIKeyPQDCQQPLFGSTHC-UHFFFAOYSA-N
XLogP1.74
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.36
LogP ≤ 51.74
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

5-acetamido-N-[1-(hydroxymethyl)-3-methylcyclohexyl]thiophene-2-carboxamide
CID 62526831
5-(cyclopropanecarbonylamino)-N-[1-(hydroxymethyl)cyclobutyl]thiophene-2-carboxamide
CID 115878168
N-[1-(hydroxymethyl)cyclohexyl]-5-methylthiophene-2-carboxamide
CID 55082075
N-[1-(hydroxymethyl)cyclopentyl]-5-nitrothiophene-2-carboxamide
CID 55082053
5-acetamido-N-[3-(hydroxymethyl)pentan-3-yl]thiophene-2-carboxamide
CID 55081960
4-[(5-acetamidothiophene-2-carbonyl)amino]-3-methylbutanoic acid
CID 81064594
2,6-dichloro-N-[1-(hydroxymethyl)cyclopentyl]benzamide
CID 62519426
5-bromo-N-[1-(hydroxymethyl)-3-methylcyclohexyl]thiophene-2-carboxamide
CID 62527720
N-[1-(hydroxymethyl)cyclobutyl]-2-methyl-1,3-thiazole-5-carboxamide
CID 103881158
5-acetamido-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]thiophene-2-carboxamide
CID 79246233
5-acetamido-N-[[4-(hydroxymethyl)phenyl]methyl]thiophene-2-carboxamide
CID 107232601
5-acetamido-N-(4-hydroxy-3-methylbutan-2-yl)thiophene-2-carboxamide
CID 115770902

Frequently Asked Questions

What is the IUPAC name of 5-acetamido-N-[1-(hydroxymethyl)cyclopentyl]thiophene-2-carboxamide?
The IUPAC name of 5-acetamido-N-[1-(hydroxymethyl)cyclopentyl]thiophene-2-carboxamide (CID 62525158) is 5-acetamido-N-[1-(hydroxymethyl)cyclopentyl]thiophene-2-carboxamide.
What is the SMILES notation for 5-acetamido-N-[1-(hydroxymethyl)cyclopentyl]thiophene-2-carboxamide?
The canonical SMILES for 5-acetamido-N-[1-(hydroxymethyl)cyclopentyl]thiophene-2-carboxamide is CC(=O)Nc1ccc(C(=O)NC2(CO)CCCC2)s1.
What is the InChIKey of 5-acetamido-N-[1-(hydroxymethyl)cyclopentyl]thiophene-2-carboxamide?
The InChIKey is PQDCQQPLFGSTHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O3S/c1-9(17)14-11-5-4-10(19-11)12(18)15-13(8-16)6-2-3-7-13/h4-5,16H,2-3,6-8H2,1H3,(H,14,17)(H,15,18).
What are the key properties of 5-acetamido-N-[1-(hydroxymethyl)cyclopentyl]thiophene-2-carboxamide?
5-acetamido-N-[1-(hydroxymethyl)cyclopentyl]thiophene-2-carboxamide has a molecular weight of 282.36 g/mol, XLogP of 1.74, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-acetamido-N-[1-(hydroxymethyl)cyclopentyl]thiophene-2-carboxamide is sourced from PubChem (CID 62525158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).