1-amino-N-(3-methylsulfonylpropyl)cyclopentane-1-carboxamide

C10H20N2O3S — CID 61036737

IUPAC1-amino-N-(3-methylsulfonylpropyl)cyclopentane-1-carboxamide
SMILESCS(=O)(=O)CCCNC(=O)C1(N)CCCC1
InChIInChI=1S/C10H20N2O3S/c1-16(14,15)8-4-7-12-9(13)10(11)5-2-3-6-10/h2-8,11H2,1H3,(H,12,13)
InChIKeyDRHROOXEKABLCO-UHFFFAOYSA-N
MW248.35 g/mol
LogP-0.19
Rot. Bonds5

About 1-amino-N-(3-methylsulfonylpropyl)cyclopentane-1-carboxamide

1-amino-N-(3-methylsulfonylpropyl)cyclopentane-1-carboxamide (PubChem CID 61036737) has the molecular formula C10H20N2O3S and a molecular weight of 248.35 g/mol. Its IUPAC name is 1-amino-N-(3-methylsulfonylpropyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-(3-methylsulfonylpropyl)cyclopentane-1-carboxamide
PubChem CID61036737
Molecular FormulaC10H20N2O3S
Molecular Weight248.35 g/mol
Exact Mass248.12
IUPAC Name1-amino-N-(3-methylsulfonylpropyl)cyclopentane-1-carboxamide
SMILESCS(=O)(=O)CCCNC(=O)C1(N)CCCC1
InChIInChI=1S/C10H20N2O3S/c1-16(14,15)8-4-7-12-9(13)10(11)5-2-3-6-10/h2-8,11H2,1H3,(H,12,13)
InChIKeyDRHROOXEKABLCO-UHFFFAOYSA-N
XLogP-0.19
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.35
LogP ≤ 5-0.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 1-amino-N-(3-methylsulfonylpropyl)cyclopentane-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

1-amino-N-[3-(methanesulfonamido)propyl]cyclohexane-1-carboxamide;hydrochloride
CID 119290733
1-(aminomethyl)-N-(3-methylsulfonylpropyl)cyclopropane-1-carboxamide
CID 80587484
1-[2-(3-methylsulfonylpropylamino)-2-oxoethyl]cyclopentane-1-carboxylic acid
CID 54906188
1-amino-N-hexadecylcyclopentane-1-carboxamide;hydrochloride
CID 162369758
N-(3-acetamidopropyl)-1-aminocyclohexane-1-carboxamide;hydrochloride
CID 119290745
1-amino-N-pentylcyclobutane-1-carboxamide
CID 81167514
4-methyl-N-(3-methylsulfonylpropyl)piperidine-4-carboxamide
CID 63122628
1-amino-N-(3-hydroxypropyl)cyclobutane-1-carboxamide
CID 81179934
1-amino-N-(3-piperidin-1-ylpropyl)cyclopentane-1-carboxamide
CID 60867938
1-amino-N-[3-(azepan-1-yl)propyl]cyclohexane-1-carboxamide
CID 119831267
1-amino-N-(4-methylpentyl)cyclobutane-1-carboxamide
CID 81172040
5-[(1-aminocyclopentanecarbonyl)amino]-2-methylpentanoic acid
CID 112547802

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-(3-methylsulfonylpropyl)cyclopentane-1-carboxamide?
The IUPAC name of 1-amino-N-(3-methylsulfonylpropyl)cyclopentane-1-carboxamide (CID 61036737) is 1-amino-N-(3-methylsulfonylpropyl)cyclopentane-1-carboxamide.
What is the SMILES notation for 1-amino-N-(3-methylsulfonylpropyl)cyclopentane-1-carboxamide?
The canonical SMILES for 1-amino-N-(3-methylsulfonylpropyl)cyclopentane-1-carboxamide is CS(=O)(=O)CCCNC(=O)C1(N)CCCC1.
What is the InChIKey of 1-amino-N-(3-methylsulfonylpropyl)cyclopentane-1-carboxamide?
The InChIKey is DRHROOXEKABLCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O3S/c1-16(14,15)8-4-7-12-9(13)10(11)5-2-3-6-10/h2-8,11H2,1H3,(H,12,13).
What are the key properties of 1-amino-N-(3-methylsulfonylpropyl)cyclopentane-1-carboxamide?
1-amino-N-(3-methylsulfonylpropyl)cyclopentane-1-carboxamide has a molecular weight of 248.35 g/mol, XLogP of -0.19, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-(3-methylsulfonylpropyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 61036737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).