3-amino-N-(1-thiophen-2-ylbutyl)cyclohexane-1-carboxamide

C15H24N2OS — CID 63045756

IUPAC3-amino-N-(1-thiophen-2-ylbutyl)cyclohexane-1-carboxamide
SMILESCCCC(NC(=O)C1CCCC(N)C1)c1cccs1
InChIInChI=1S/C15H24N2OS/c1-2-5-13(14-8-4-9-19-14)17-15(18)11-6-3-7-12(16)10-11/h4,8-9,11-13H,2-3,5-7,10,16H2,1H3,(H,17,18)
InChIKeyAHUOGPLVCVNZQH-UHFFFAOYSA-N
MW280.44 g/mol
LogP3.22
Rot. Bonds5

About 3-amino-N-(1-thiophen-2-ylbutyl)cyclohexane-1-carboxamide

3-amino-N-(1-thiophen-2-ylbutyl)cyclohexane-1-carboxamide (PubChem CID 63045756) has the molecular formula C15H24N2OS and a molecular weight of 280.44 g/mol. Its IUPAC name is 3-amino-N-(1-thiophen-2-ylbutyl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name3-amino-N-(1-thiophen-2-ylbutyl)cyclohexane-1-carboxamide
PubChem CID63045756
Molecular FormulaC15H24N2OS
Molecular Weight280.44 g/mol
Exact Mass280.16
IUPAC Name3-amino-N-(1-thiophen-2-ylbutyl)cyclohexane-1-carboxamide
SMILESCCCC(NC(=O)C1CCCC(N)C1)c1cccs1
InChIInChI=1S/C15H24N2OS/c1-2-5-13(14-8-4-9-19-14)17-15(18)11-6-3-7-12(16)10-11/h4,8-9,11-13H,2-3,5-7,10,16H2,1H3,(H,17,18)
InChIKeyAHUOGPLVCVNZQH-UHFFFAOYSA-N
XLogP3.22
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.44
LogP ≤ 53.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-amino-N-(1-thiophen-2-ylbutyl)cyclohexane-1-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

methyl 3-[(3-aminocyclopentanecarbonyl)amino]-3-thiophen-2-ylpropanoate
CID 66009978
N-(1-thiophen-2-ylbutyl)pyrrolidine-2-carboxamide
CID 54962408
3-amino-N-(1-pyridin-4-ylpropyl)cyclohexane-1-carboxamide;dihydrochloride
CID 119884887
2-cyclopentyl-1-(1-thiophen-2-ylbutyl)guanidine
CID 62370058
3-amino-3-sulfanylidene-N-(1-thiophen-2-ylbutyl)propanamide
CID 55134581
3-amino-N-[2-(dimethylamino)-1-phenylethyl]cyclohexane-1-carboxamide;dihydrochloride
CID 119836139
4-methyl-N-(1-thiophen-2-ylbutyl)pyrrolidine-3-carboxamide
CID 63716522
(3S)-N-(1-thiophen-2-ylpropyl)piperidine-3-carboxamide
CID 81139457
3-amino-N-(2-methyl-2-thiophen-2-ylpropyl)cyclohexane-1-carboxamide
CID 80527416
1-carbamothioyl-N-(1-thiophen-2-ylbutyl)cyclobutane-1-carboxamide
CID 80589308
3-methyl-N-(1-thiophen-2-ylbutyl)cyclohexan-1-amine
CID 55194083
2,2-difluoro-N-(1-thiophen-2-ylbutyl)acetamide
CID 103515707

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(1-thiophen-2-ylbutyl)cyclohexane-1-carboxamide?
The IUPAC name of 3-amino-N-(1-thiophen-2-ylbutyl)cyclohexane-1-carboxamide (CID 63045756) is 3-amino-N-(1-thiophen-2-ylbutyl)cyclohexane-1-carboxamide.
What is the SMILES notation for 3-amino-N-(1-thiophen-2-ylbutyl)cyclohexane-1-carboxamide?
The canonical SMILES for 3-amino-N-(1-thiophen-2-ylbutyl)cyclohexane-1-carboxamide is CCCC(NC(=O)C1CCCC(N)C1)c1cccs1.
What is the InChIKey of 3-amino-N-(1-thiophen-2-ylbutyl)cyclohexane-1-carboxamide?
The InChIKey is AHUOGPLVCVNZQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2OS/c1-2-5-13(14-8-4-9-19-14)17-15(18)11-6-3-7-12(16)10-11/h4,8-9,11-13H,2-3,5-7,10,16H2,1H3,(H,17,18).
What are the key properties of 3-amino-N-(1-thiophen-2-ylbutyl)cyclohexane-1-carboxamide?
3-amino-N-(1-thiophen-2-ylbutyl)cyclohexane-1-carboxamide has a molecular weight of 280.44 g/mol, XLogP of 3.22, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(1-thiophen-2-ylbutyl)cyclohexane-1-carboxamide is sourced from PubChem (CID 63045756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).