N-(1-aminopropan-2-yl)-5-chlorothiophene-2-carboxamide

C8H11ClN2OS — CID 63733398

IUPACN-(1-aminopropan-2-yl)-5-chlorothiophene-2-carboxamide
SMILESCC(CN)NC(=O)c1ccc(Cl)s1
InChIInChI=1S/C8H11ClN2OS/c1-5(4-10)11-8(12)6-2-3-7(9)13-6/h2-3,5H,4,10H2,1H3,(H,11,12)
InChIKeyVYMWOLSFLFTVDK-UHFFFAOYSA-N
MW218.71 g/mol
LogP1.48
Rot. Bonds3

About N-(1-aminopropan-2-yl)-5-chlorothiophene-2-carboxamide

N-(1-aminopropan-2-yl)-5-chlorothiophene-2-carboxamide (PubChem CID 63733398) has the molecular formula C8H11ClN2OS and a molecular weight of 218.71 g/mol. Its IUPAC name is N-(1-aminopropan-2-yl)-5-chlorothiophene-2-carboxamide.

Molecular Properties

Compound NameN-(1-aminopropan-2-yl)-5-chlorothiophene-2-carboxamide
PubChem CID63733398
Molecular FormulaC8H11ClN2OS
Molecular Weight218.71 g/mol
Exact Mass218.03
IUPAC NameN-(1-aminopropan-2-yl)-5-chlorothiophene-2-carboxamide
SMILESCC(CN)NC(=O)c1ccc(Cl)s1
InChIInChI=1S/C8H11ClN2OS/c1-5(4-10)11-8(12)6-2-3-7(9)13-6/h2-3,5H,4,10H2,1H3,(H,11,12)
InChIKeyVYMWOLSFLFTVDK-UHFFFAOYSA-N
XLogP1.48
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.71
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(1-aminopropan-2-yl)-5-chlorothiophene-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

5-chloro-N-[(2R)-1-hydroxypropan-2-yl]thiophene-2-carboxamide
CID 79030843
5-chloro-N-[2-[(5-chlorothiophene-2-carbonyl)amino]propyl]thiophene-2-carboxamide
CID 3490004
N-[(2S)-1-aminopropan-2-yl]-5-methylthiophene-2-carboxamide
CID 131159537
N-(5-bromopentan-2-yl)-5-chlorothiophene-2-carboxamide
CID 114316562
N-[(2R)-1-aminopropan-2-yl]-5-ethylthiophene-2-carboxamide
CID 104873084
5-chloro-N-propan-2-yloxythiophene-2-carboxamide
CID 131162409
5-chloro-N-(1-hydroxy-4-methylpentan-2-yl)thiophene-2-carboxamide
CID 61247076
5-chloro-N-[1-(2,6-dimethylphenoxy)propan-2-yl]thiophene-2-carboxamide
CID 3668905
5-chloro-N-[(1S)-1-phenylethyl]thiophene-2-carboxamide
CID 9330177
diethyl 2-[(5-chlorothiophene-2-carbonyl)amino]propanedioate
CID 33241351
N-(2-amino-1-cyclopropylethyl)-5-chlorothiophene-2-carboxamide;hydrochloride
CID 119617339
5-chloro-N-(1-cyano-2-methylpropyl)thiophene-2-carboxamide
CID 63941006

Frequently Asked Questions

What is the IUPAC name of N-(1-aminopropan-2-yl)-5-chlorothiophene-2-carboxamide?
The IUPAC name of N-(1-aminopropan-2-yl)-5-chlorothiophene-2-carboxamide (CID 63733398) is N-(1-aminopropan-2-yl)-5-chlorothiophene-2-carboxamide.
What is the SMILES notation for N-(1-aminopropan-2-yl)-5-chlorothiophene-2-carboxamide?
The canonical SMILES for N-(1-aminopropan-2-yl)-5-chlorothiophene-2-carboxamide is CC(CN)NC(=O)c1ccc(Cl)s1.
What is the InChIKey of N-(1-aminopropan-2-yl)-5-chlorothiophene-2-carboxamide?
The InChIKey is VYMWOLSFLFTVDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11ClN2OS/c1-5(4-10)11-8(12)6-2-3-7(9)13-6/h2-3,5H,4,10H2,1H3,(H,11,12).
What are the key properties of N-(1-aminopropan-2-yl)-5-chlorothiophene-2-carboxamide?
N-(1-aminopropan-2-yl)-5-chlorothiophene-2-carboxamide has a molecular weight of 218.71 g/mol, XLogP of 1.48, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-aminopropan-2-yl)-5-chlorothiophene-2-carboxamide is sourced from PubChem (CID 63733398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).