(2R)-2-amino-N-formyl-3-sulfanylpropanamide

C4H8N2O2S — CID 175062491

IUPAC(2R)-2-amino-N-formyl-3-sulfanylpropanamide
SMILESN[C@@H](CS)C(=O)NC=O
InChIInChI=1S/C4H8N2O2S/c5-3(1-9)4(8)6-2-7/h2-3,9H,1,5H2,(H,6,7,8)/t3-/m0/s1
InChIKeyNMDDQUSZSFTQMM-VKHMYHEASA-N
MW148.19 g/mol
LogP-1.48
Rot. Bonds3

About (2R)-2-amino-N-formyl-3-sulfanylpropanamide

(2R)-2-amino-N-formyl-3-sulfanylpropanamide (PubChem CID 175062491) has the molecular formula C4H8N2O2S and a molecular weight of 148.19 g/mol. Its IUPAC name is (2R)-2-amino-N-formyl-3-sulfanylpropanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-formyl-3-sulfanylpropanamide
PubChem CID175062491
Molecular FormulaC4H8N2O2S
Molecular Weight148.19 g/mol
Exact Mass148.03
IUPAC Name(2R)-2-amino-N-formyl-3-sulfanylpropanamide
SMILESN[C@@H](CS)C(=O)NC=O
InChIInChI=1S/C4H8N2O2S/c5-3(1-9)4(8)6-2-7/h2-3,9H,1,5H2,(H,6,7,8)/t3-/m0/s1
InChIKeyNMDDQUSZSFTQMM-VKHMYHEASA-N
XLogP-1.48
TPSA72.19 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.19
LogP ≤ 5-1.48
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'thiol_2', 'substructure': 'N/A'}

Analyze (2R)-2-amino-N-formyl-3-sulfanylpropanamide 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

CID 87623250
CID 87623250
(2R)-2-amino-N-ethyl-3-sulfanylpropanamide;hydrochloride
CID 139691176
(2R)-2-amino-3-sulfanylpropaneperoxoic acid
CID 91512911
bis[(2R)-2-amino-3-sulfanylpropanoyl] propanedioate
CID 57148534
2-amino-5-[(2-amino-3-sulfanylpropanoyl)amino]-5-oxopentanoic acid
CID 131750738
2-amino-3-sulfanylpropanoic acid
CID 21459566
(2R)-2-amino-3-sulfanylpropanoic acid;2-amino-3-sulfanylpropanoic acid
CID 87266348
(2S)-2-amino-3-sulfanylpropanoic acid;2-amino-3-sulfanylpropanoic acid
CID 138731668
[(2R)-2-amino-3-sulfanylpropanoyl]oxycarbonyl (2R)-2-amino-3-sulfanylpropanoate
CID 174802205
(2R)-2-amino-4-formamido-4-oxobutanoic acid
CID 131868745
2-amino-3-sulfanylpropanoic acid;hydrofluoride
CID 174867150
2-amino-3-sulfanylpropanoyl chloride
CID 23199161

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-formyl-3-sulfanylpropanamide?
The IUPAC name of (2R)-2-amino-N-formyl-3-sulfanylpropanamide (CID 175062491) is (2R)-2-amino-N-formyl-3-sulfanylpropanamide.
What is the SMILES notation for (2R)-2-amino-N-formyl-3-sulfanylpropanamide?
The canonical SMILES for (2R)-2-amino-N-formyl-3-sulfanylpropanamide is N[C@@H](CS)C(=O)NC=O.
What is the InChIKey of (2R)-2-amino-N-formyl-3-sulfanylpropanamide?
The InChIKey is NMDDQUSZSFTQMM-VKHMYHEASA-N. The full InChI is InChI=1S/C4H8N2O2S/c5-3(1-9)4(8)6-2-7/h2-3,9H,1,5H2,(H,6,7,8)/t3-/m0/s1.
What are the key properties of (2R)-2-amino-N-formyl-3-sulfanylpropanamide?
(2R)-2-amino-N-formyl-3-sulfanylpropanamide has a molecular weight of 148.19 g/mol, XLogP of -1.48, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-formyl-3-sulfanylpropanamide is sourced from PubChem (CID 175062491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).