3-amino-N-[(1,1-dioxothiolan-3-yl)methyl]cyclopentane-1-carboxamide

C11H20N2O3S — CID 66007941

IUPAC3-amino-N-[(1,1-dioxothiolan-3-yl)methyl]cyclopentane-1-carboxamide
SMILESNC1CCC(C(=O)NCC2CCS(=O)(=O)C2)C1
InChIInChI=1S/C11H20N2O3S/c12-10-2-1-9(5-10)11(14)13-6-8-3-4-17(15,16)7-8/h8-10H,1-7,12H2,(H,13,14)
InChIKeySGIFQHNPXDFHJX-UHFFFAOYSA-N
MW260.36 g/mol
LogP-0.34
Rot. Bonds3

About 3-amino-N-[(1,1-dioxothiolan-3-yl)methyl]cyclopentane-1-carboxamide

3-amino-N-[(1,1-dioxothiolan-3-yl)methyl]cyclopentane-1-carboxamide (PubChem CID 66007941) has the molecular formula C11H20N2O3S and a molecular weight of 260.36 g/mol. Its IUPAC name is 3-amino-N-[(1,1-dioxothiolan-3-yl)methyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name3-amino-N-[(1,1-dioxothiolan-3-yl)methyl]cyclopentane-1-carboxamide
PubChem CID66007941
Molecular FormulaC11H20N2O3S
Molecular Weight260.36 g/mol
Exact Mass260.12
IUPAC Name3-amino-N-[(1,1-dioxothiolan-3-yl)methyl]cyclopentane-1-carboxamide
SMILESNC1CCC(C(=O)NCC2CCS(=O)(=O)C2)C1
InChIInChI=1S/C11H20N2O3S/c12-10-2-1-9(5-10)11(14)13-6-8-3-4-17(15,16)7-8/h8-10H,1-7,12H2,(H,13,14)
InChIKeySGIFQHNPXDFHJX-UHFFFAOYSA-N
XLogP-0.34
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.36
LogP ≤ 5-0.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-amino-N-[(1,1-dioxothiolan-3-yl)methyl]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

3-amino-N-(1,1-dioxothian-4-yl)cyclopentane-1-carboxamide
CID 66032491
N-[(3-aminocyclobutyl)methyl]cyclopropanecarboxamide
CID 66004927
(2S)-2-amino-N-[[(3R)-1,1-dioxothiolan-3-yl]methyl]propanamide
CID 51892168
ethyl N-[(1,1-dioxothiolan-3-yl)methyl]carbamate
CID 3091624
3-amino-N-[(1-ethylpiperidin-4-yl)methyl]cyclopentane-1-carboxamide
CID 66008591
3-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)cyclopentane-1-carboxamide
CID 66010683
6-[(1,1-dioxothiolan-3-yl)methylcarbamoyloxy]hexyl N-[(1,1-dioxothiolan-3-yl)methyl]carbamate
CID 43828162
N-[(1,1-dioxothiolan-3-yl)methyl]-2-(methylamino)acetamide
CID 61058518
3-amino-N-[(3-hydroxycyclobutyl)methyl]cyclohexane-1-carboxamide
CID 66005543
N-[(3-aminocyclopentyl)methyl]-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene-2-carboxamide
CID 106121226
2-amino-N-[(1,1-dioxothiolan-3-yl)methyl]-3-methylbutanamide
CID 61058403
1-(3-aminopropyl)-3-[(1,1-dioxothiolan-3-yl)methyl]urea
CID 117234622

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[(1,1-dioxothiolan-3-yl)methyl]cyclopentane-1-carboxamide?
The IUPAC name of 3-amino-N-[(1,1-dioxothiolan-3-yl)methyl]cyclopentane-1-carboxamide (CID 66007941) is 3-amino-N-[(1,1-dioxothiolan-3-yl)methyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 3-amino-N-[(1,1-dioxothiolan-3-yl)methyl]cyclopentane-1-carboxamide?
The canonical SMILES for 3-amino-N-[(1,1-dioxothiolan-3-yl)methyl]cyclopentane-1-carboxamide is NC1CCC(C(=O)NCC2CCS(=O)(=O)C2)C1.
What is the InChIKey of 3-amino-N-[(1,1-dioxothiolan-3-yl)methyl]cyclopentane-1-carboxamide?
The InChIKey is SGIFQHNPXDFHJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O3S/c12-10-2-1-9(5-10)11(14)13-6-8-3-4-17(15,16)7-8/h8-10H,1-7,12H2,(H,13,14).
What are the key properties of 3-amino-N-[(1,1-dioxothiolan-3-yl)methyl]cyclopentane-1-carboxamide?
3-amino-N-[(1,1-dioxothiolan-3-yl)methyl]cyclopentane-1-carboxamide has a molecular weight of 260.36 g/mol, XLogP of -0.34, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[(1,1-dioxothiolan-3-yl)methyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 66007941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).