N-(4-hydroxyoxolan-3-yl)methanesulfinamide

C5H11NO3S — CID 130680333

IUPACN-(4-hydroxyoxolan-3-yl)methanesulfinamide
SMILESCS(=O)NC1COCC1O
InChIInChI=1S/C5H11NO3S/c1-10(8)6-4-2-9-3-5(4)7/h4-7H,2-3H2,1H3
InChIKeyUKDKPKPHNNLYFQ-UHFFFAOYSA-N
MW165.21 g/mol
LogP-1.37
Rot. Bonds2

About N-(4-hydroxyoxolan-3-yl)methanesulfinamide

N-(4-hydroxyoxolan-3-yl)methanesulfinamide (PubChem CID 130680333) has the molecular formula C5H11NO3S and a molecular weight of 165.21 g/mol. Its IUPAC name is N-(4-hydroxyoxolan-3-yl)methanesulfinamide.

Molecular Properties

Compound NameN-(4-hydroxyoxolan-3-yl)methanesulfinamide
PubChem CID130680333
Molecular FormulaC5H11NO3S
Molecular Weight165.21 g/mol
Exact Mass165.05
IUPAC NameN-(4-hydroxyoxolan-3-yl)methanesulfinamide
SMILESCS(=O)NC1COCC1O
InChIInChI=1S/C5H11NO3S/c1-10(8)6-4-2-9-3-5(4)7/h4-7H,2-3H2,1H3
InChIKeyUKDKPKPHNNLYFQ-UHFFFAOYSA-N
XLogP-1.37
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.21
LogP ≤ 5-1.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(4-hydroxyoxolan-3-yl)methanesulfinamide 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

Trans-4-Amino-Tetrahydro-Furan-3-Ol
CID 9793712
rac-(3R,4S)-4-aminooxolan-3-ol
CID 11768516
(3R,4R)-4-Aminooxolan-3-ol
CID 33746102
1,1-difluoro-N-(4-hydroxyoxolan-3-yl)methanesulfonamide
CID 130831677
4-Aminotetrahydrofuran-3-ol
CID 10486809
(3S,4S)-4-Aminotetrahydrofuran-3-ol
CID 10942358
[(3S,4R)-4-hydroxyoxolan-3-yl]azanium
CID 25632302
[(4S)-4-hydroxyoxolan-3-yl]azanium
CID 59063636
(3S)-4-aminooxolan-3-ol
CID 59063637
(4S)-4-aminooxolan-3-ol
CID 59883180
(3R)-4-aminooxolan-3-ol
CID 59883186
N-(4-hydroxytetrahydrofuran-3-yl)propane-2-sulfonamide
CID 67196244

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxyoxolan-3-yl)methanesulfinamide?
The IUPAC name of N-(4-hydroxyoxolan-3-yl)methanesulfinamide (CID 130680333) is N-(4-hydroxyoxolan-3-yl)methanesulfinamide.
What is the SMILES notation for N-(4-hydroxyoxolan-3-yl)methanesulfinamide?
The canonical SMILES for N-(4-hydroxyoxolan-3-yl)methanesulfinamide is CS(=O)NC1COCC1O.
What is the InChIKey of N-(4-hydroxyoxolan-3-yl)methanesulfinamide?
The InChIKey is UKDKPKPHNNLYFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO3S/c1-10(8)6-4-2-9-3-5(4)7/h4-7H,2-3H2,1H3.
What are the key properties of N-(4-hydroxyoxolan-3-yl)methanesulfinamide?
N-(4-hydroxyoxolan-3-yl)methanesulfinamide has a molecular weight of 165.21 g/mol, XLogP of -1.37, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxyoxolan-3-yl)methanesulfinamide is sourced from PubChem (CID 130680333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).