(2R)-2-amino-N-(3-hydroxy-2-pyridinyl)-4-methylsulfanylbutanamide

C10H15N3O2S — CID 104908993

IUPAC(2R)-2-amino-N-(3-hydroxy-2-pyridinyl)-4-methylsulfanylbutanamide
SMILESCSCC[C@@H](N)C(=O)Nc1ncccc1O
InChIInChI=1S/C10H15N3O2S/c1-16-6-4-7(11)10(15)13-9-8(14)3-2-5-12-9/h2-3,5,7,14H,4,6,11H2,1H3,(H,12,13,15)/t7-/m1/s1
InChIKeyFVGBSHCCJZPFPC-SSDOTTSWSA-N
MW241.32 g/mol
LogP0.81
Rot. Bonds5

About (2R)-2-amino-N-(3-hydroxy-2-pyridinyl)-4-methylsulfanylbutanamide

(2R)-2-amino-N-(3-hydroxy-2-pyridinyl)-4-methylsulfanylbutanamide (PubChem CID 104908993) has the molecular formula C10H15N3O2S and a molecular weight of 241.32 g/mol. Its IUPAC name is (2R)-2-amino-N-(3-hydroxy-2-pyridinyl)-4-methylsulfanylbutanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-(3-hydroxy-2-pyridinyl)-4-methylsulfanylbutanamide
PubChem CID104908993
Molecular FormulaC10H15N3O2S
Molecular Weight241.32 g/mol
Exact Mass241.09
IUPAC Name(2R)-2-amino-N-(3-hydroxy-2-pyridinyl)-4-methylsulfanylbutanamide
SMILESCSCC[C@@H](N)C(=O)Nc1ncccc1O
InChIInChI=1S/C10H15N3O2S/c1-16-6-4-7(11)10(15)13-9-8(14)3-2-5-12-9/h2-3,5,7,14H,4,6,11H2,1H3,(H,12,13,15)/t7-/m1/s1
InChIKeyFVGBSHCCJZPFPC-SSDOTTSWSA-N
XLogP0.81
TPSA88.24 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.32
LogP ≤ 50.81
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze (2R)-2-amino-N-(3-hydroxy-2-pyridinyl)-4-methylsulfanylbutanamide 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

(2S)-2-amino-N-(3-methyl-2-pyridinyl)-4-methylsulfanylbutanamide
CID 61148284
(2S)-2-amino-N-(3-hydroxy-2-pyridinyl)pentanamide
CID 107570512
4-amino-5-[(3-hydroxy-2-pyridinyl)amino]-5-oxopentanoic acid
CID 113392266
(2S)-2-amino-N-(3-hydroxy-2-pyridinyl)propanamide
CID 103630280
(2S)-2-amino-4-methylsulfanyl-N-pyridin-4-ylbutanamide
CID 61148006
(2R)-2-amino-N-(3-methyl-2-pyridinyl)pentanamide
CID 107568105
(2S)-2-amino-N-(6-chloro-3-pyridinyl)-4-methylsulfanylbutanamide
CID 81425127
(2S)-2-amino-N-(2-ethoxyphenyl)-4-methylsulfanylbutanamide
CID 22691913
(2S)-2-amino-N-(2-chloropyrimidin-4-yl)-4-methylsulfanylbutanamide
CID 104893497
5-[[(2R)-2-amino-4-methylsulfanylbutanoyl]amino]pyridine-2-carboxylic acid
CID 104908861
(2S)-2-amino-N-(2-ethylphenyl)-4-methylsulfanylbutanamide
CID 22691889
(2R)-2-amino-N-(5-bromo-3-methyl-2-pyridinyl)-4-methylsulfanylbutanamide
CID 104908962

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-(3-hydroxy-2-pyridinyl)-4-methylsulfanylbutanamide?
The IUPAC name of (2R)-2-amino-N-(3-hydroxy-2-pyridinyl)-4-methylsulfanylbutanamide (CID 104908993) is (2R)-2-amino-N-(3-hydroxy-2-pyridinyl)-4-methylsulfanylbutanamide.
What is the SMILES notation for (2R)-2-amino-N-(3-hydroxy-2-pyridinyl)-4-methylsulfanylbutanamide?
The canonical SMILES for (2R)-2-amino-N-(3-hydroxy-2-pyridinyl)-4-methylsulfanylbutanamide is CSCC[C@@H](N)C(=O)Nc1ncccc1O.
What is the InChIKey of (2R)-2-amino-N-(3-hydroxy-2-pyridinyl)-4-methylsulfanylbutanamide?
The InChIKey is FVGBSHCCJZPFPC-SSDOTTSWSA-N. The full InChI is InChI=1S/C10H15N3O2S/c1-16-6-4-7(11)10(15)13-9-8(14)3-2-5-12-9/h2-3,5,7,14H,4,6,11H2,1H3,(H,12,13,15)/t7-/m1/s1.
What are the key properties of (2R)-2-amino-N-(3-hydroxy-2-pyridinyl)-4-methylsulfanylbutanamide?
(2R)-2-amino-N-(3-hydroxy-2-pyridinyl)-4-methylsulfanylbutanamide has a molecular weight of 241.32 g/mol, XLogP of 0.81, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-(3-hydroxy-2-pyridinyl)-4-methylsulfanylbutanamide is sourced from PubChem (CID 104908993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).