(2R)-2-amino-N-(2-ethylsulfinylethyl)propanamide

C7H16N2O2S — CID 103796520

IUPAC(2R)-2-amino-N-(2-ethylsulfinylethyl)propanamide
SMILESCCS(=O)CCNC(=O)[C@@H](C)N
InChIInChI=1S/C7H16N2O2S/c1-3-12(11)5-4-9-7(10)6(2)8/h6H,3-5,8H2,1-2H3,(H,9,10)/t6-,12?/m1/s1
InChIKeyOOQQZLMDIASFNA-ZJGHLTBISA-N
MW192.28 g/mol
LogP-0.78
Rot. Bonds5

About (2R)-2-amino-N-(2-ethylsulfinylethyl)propanamide

(2R)-2-amino-N-(2-ethylsulfinylethyl)propanamide (PubChem CID 103796520) has the molecular formula C7H16N2O2S and a molecular weight of 192.28 g/mol. Its IUPAC name is (2R)-2-amino-N-(2-ethylsulfinylethyl)propanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-(2-ethylsulfinylethyl)propanamide
PubChem CID103796520
Molecular FormulaC7H16N2O2S
Molecular Weight192.28 g/mol
Exact Mass192.09
IUPAC Name(2R)-2-amino-N-(2-ethylsulfinylethyl)propanamide
SMILESCCS(=O)CCNC(=O)[C@@H](C)N
InChIInChI=1S/C7H16N2O2S/c1-3-12(11)5-4-9-7(10)6(2)8/h6H,3-5,8H2,1-2H3,(H,9,10)/t6-,12?/m1/s1
InChIKeyOOQQZLMDIASFNA-ZJGHLTBISA-N
XLogP-0.78
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.28
LogP ≤ 5-0.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (2R)-2-amino-N-(2-ethylsulfinylethyl)propanamide 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-(2-ethylsulfinylethyl)-3-methylbutanamide
CID 103796523
(2S)-2-amino-N-[2-[[(2S)-2-aminopropanoyl]amino]ethyl]propanamide;dihydrochloride
CID 18651575
2-amino-N-propylpropanamide;ethane
CID 142837247
1-(2-ethylsulfinylethyl)-3-methylurea
CID 115645018
2-(2-ethylsulfinylethylamino)-N-(3-methylbutyl)propanamide
CID 113494710
(2S)-2-amino-N-butyl(113C)propanamide
CID 157365112
(2S)-2-amino-N-butylpropan(15N)amide
CID 158456310
(2S)-2-amino-N-(3-methylsulfinylbutyl)propanamide
CID 103798205
(2R)-2-amino-N-(2-fluoroethyl)propanamide
CID 90216538
(2S)-2-amino-N-(2-chloroethyl)propanamide
CID 55302965
2-(2-ethylsulfinylethylamino)-N-(2,2,2-trifluoroethyl)propanamide
CID 113494695
4-(2-ethylsulfinylethylamino)-2-methyl-4-oxo-2-propan-2-ylbutanoic acid
CID 113494470

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-(2-ethylsulfinylethyl)propanamide?
The IUPAC name of (2R)-2-amino-N-(2-ethylsulfinylethyl)propanamide (CID 103796520) is (2R)-2-amino-N-(2-ethylsulfinylethyl)propanamide.
What is the SMILES notation for (2R)-2-amino-N-(2-ethylsulfinylethyl)propanamide?
The canonical SMILES for (2R)-2-amino-N-(2-ethylsulfinylethyl)propanamide is CCS(=O)CCNC(=O)[C@@H](C)N.
What is the InChIKey of (2R)-2-amino-N-(2-ethylsulfinylethyl)propanamide?
The InChIKey is OOQQZLMDIASFNA-ZJGHLTBISA-N. The full InChI is InChI=1S/C7H16N2O2S/c1-3-12(11)5-4-9-7(10)6(2)8/h6H,3-5,8H2,1-2H3,(H,9,10)/t6-,12?/m1/s1.
What are the key properties of (2R)-2-amino-N-(2-ethylsulfinylethyl)propanamide?
(2R)-2-amino-N-(2-ethylsulfinylethyl)propanamide has a molecular weight of 192.28 g/mol, XLogP of -0.78, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-(2-ethylsulfinylethyl)propanamide is sourced from PubChem (CID 103796520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).