3-amino-N-[1-(hydroxymethyl)cyclohexyl]thiophene-2-carboxamide

C12H18N2O2S — CID 62526740

IUPAC3-amino-N-[1-(hydroxymethyl)cyclohexyl]thiophene-2-carboxamide
SMILESNc1ccsc1C(=O)NC1(CO)CCCCC1
InChIInChI=1S/C12H18N2O2S/c13-9-4-7-17-10(9)11(16)14-12(8-15)5-2-1-3-6-12/h4,7,15H,1-3,5-6,8,13H2,(H,14,16)
InChIKeyWZUOZWVFLSUTCS-UHFFFAOYSA-N
MW254.35 g/mol
LogP1.76
Rot. Bonds3

About 3-amino-N-[1-(hydroxymethyl)cyclohexyl]thiophene-2-carboxamide

3-amino-N-[1-(hydroxymethyl)cyclohexyl]thiophene-2-carboxamide (PubChem CID 62526740) has the molecular formula C12H18N2O2S and a molecular weight of 254.35 g/mol. Its IUPAC name is 3-amino-N-[1-(hydroxymethyl)cyclohexyl]thiophene-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-[1-(hydroxymethyl)cyclohexyl]thiophene-2-carboxamide
PubChem CID62526740
Molecular FormulaC12H18N2O2S
Molecular Weight254.35 g/mol
Exact Mass254.11
IUPAC Name3-amino-N-[1-(hydroxymethyl)cyclohexyl]thiophene-2-carboxamide
SMILESNc1ccsc1C(=O)NC1(CO)CCCCC1
InChIInChI=1S/C12H18N2O2S/c13-9-4-7-17-10(9)11(16)14-12(8-15)5-2-1-3-6-12/h4,7,15H,1-3,5-6,8,13H2,(H,14,16)
InChIKeyWZUOZWVFLSUTCS-UHFFFAOYSA-N
XLogP1.76
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.35
LogP ≤ 51.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 3-amino-N-[1-(hydroxymethyl)cyclohexyl]thiophene-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[1-(hydroxymethyl)cyclohexyl]-3-methoxythiophene-2-carboxamide
CID 81122084
N-[1-(hydroxymethyl)cyclopentyl]-3-phenylthiophene-2-carboxamide
CID 62519290
3-bromo-N-[1-(hydroxymethyl)cyclobutyl]thiophene-2-carboxamide
CID 115878426
N-[1-(hydroxymethyl)cyclohexyl]-3-(tetrazol-1-yl)thiophene-2-carboxamide
CID 62520559
N-[1-(hydroxymethyl)cyclohexyl]thiophene-3-carboxamide
CID 62520743
3-bromo-N-[1-(chloromethyl)cyclohexyl]thiophene-2-carboxamide
CID 114303411
3-bromo-N-[1-(bromomethyl)cyclopentyl]thiophene-2-carboxamide
CID 114311405
3-amino-N-[1-(hydroxymethyl)cyclohexyl]pyridine-2-carboxamide
CID 113447709
N-[4-(hydroxymethyl)oxan-4-yl]-3-methylthiophene-2-carboxamide
CID 113358062
4-amino-3,5-dichloro-N-[1-(hydroxymethyl)cyclopentyl]benzamide
CID 82833008
3-amino-4-fluoro-N-[1-(hydroxymethyl)cyclopentyl]benzamide
CID 62524113
3-ethyl-N-[1-(hydroxymethyl)-3-methylcyclohexyl]thiophene-2-carboxamide
CID 62527564

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[1-(hydroxymethyl)cyclohexyl]thiophene-2-carboxamide?
The IUPAC name of 3-amino-N-[1-(hydroxymethyl)cyclohexyl]thiophene-2-carboxamide (CID 62526740) is 3-amino-N-[1-(hydroxymethyl)cyclohexyl]thiophene-2-carboxamide.
What is the SMILES notation for 3-amino-N-[1-(hydroxymethyl)cyclohexyl]thiophene-2-carboxamide?
The canonical SMILES for 3-amino-N-[1-(hydroxymethyl)cyclohexyl]thiophene-2-carboxamide is Nc1ccsc1C(=O)NC1(CO)CCCCC1.
What is the InChIKey of 3-amino-N-[1-(hydroxymethyl)cyclohexyl]thiophene-2-carboxamide?
The InChIKey is WZUOZWVFLSUTCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2S/c13-9-4-7-17-10(9)11(16)14-12(8-15)5-2-1-3-6-12/h4,7,15H,1-3,5-6,8,13H2,(H,14,16).
What are the key properties of 3-amino-N-[1-(hydroxymethyl)cyclohexyl]thiophene-2-carboxamide?
3-amino-N-[1-(hydroxymethyl)cyclohexyl]thiophene-2-carboxamide has a molecular weight of 254.35 g/mol, XLogP of 1.76, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[1-(hydroxymethyl)cyclohexyl]thiophene-2-carboxamide is sourced from PubChem (CID 62526740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).