1-aminocyclopentane-1-sulfinic acid

C5H11NO2S — CID 175449699

IUPAC1-aminocyclopentane-1-sulfinic acid
SMILESNC1(S(=O)O)CCCC1
InChIInChI=1S/C5H11NO2S/c6-5(9(7)8)3-1-2-4-5/h1-4,6H2,(H,7,8)
InChIKeyGVZUAIHPEXFPRI-UHFFFAOYSA-N
MW149.22 g/mol
LogP0.44
Rot. Bonds1

About 1-aminocyclopentane-1-sulfinic acid

1-aminocyclopentane-1-sulfinic acid (PubChem CID 175449699) has the molecular formula C5H11NO2S and a molecular weight of 149.22 g/mol. Its IUPAC name is 1-aminocyclopentane-1-sulfinic acid.

Molecular Properties

Compound Name1-aminocyclopentane-1-sulfinic acid
PubChem CID175449699
Molecular FormulaC5H11NO2S
Molecular Weight149.22 g/mol
Exact Mass149.05
IUPAC Name1-aminocyclopentane-1-sulfinic acid
SMILESNC1(S(=O)O)CCCC1
InChIInChI=1S/C5H11NO2S/c6-5(9(7)8)3-1-2-4-5/h1-4,6H2,(H,7,8)
InChIKeyGVZUAIHPEXFPRI-UHFFFAOYSA-N
XLogP0.44
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.22
LogP ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 1-aminocyclopentane-1-sulfinic acid 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-aminocyclopentane-1-carboxylic acid
CID 2901
carbonic acid;cyclohexane-1,1-diamine
CID 175516465
1-aminocyclopentane-1-carboxamide
CID 139066563
CID 145159895
CID 145159895
1-aminocyclohenicosane-1-carboxylic acid
CID 101359672
1-aminocyclotridecane-1-carboxylic acid
CID 53441426
(1-aminocyclopentyl)phosphonic acid
CID 2733968
4-(1-aminocyclopentyl)butan-2-one
CID 59453961
1-aminocyclopentane-1-carbaldehyde;methanol
CID 142267207
1-aminocyclopentane-1-carboxamide;ethane
CID 176999310
(1-phenylcyclopentyl) hydrogen sulfite
CID 66796702
bis(cyclodecane);cyclodecane-1,1-diamine
CID 22325955

Frequently Asked Questions

What is the IUPAC name of 1-aminocyclopentane-1-sulfinic acid?
The IUPAC name of 1-aminocyclopentane-1-sulfinic acid (CID 175449699) is 1-aminocyclopentane-1-sulfinic acid.
What is the SMILES notation for 1-aminocyclopentane-1-sulfinic acid?
The canonical SMILES for 1-aminocyclopentane-1-sulfinic acid is NC1(S(=O)O)CCCC1.
What is the InChIKey of 1-aminocyclopentane-1-sulfinic acid?
The InChIKey is GVZUAIHPEXFPRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO2S/c6-5(9(7)8)3-1-2-4-5/h1-4,6H2,(H,7,8).
What are the key properties of 1-aminocyclopentane-1-sulfinic acid?
1-aminocyclopentane-1-sulfinic acid has a molecular weight of 149.22 g/mol, XLogP of 0.44, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-aminocyclopentane-1-sulfinic acid is sourced from PubChem (CID 175449699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).