(2S)-2-amino-N-(2-methoxy-5-methylphenyl)propanamide

C11H16N2O2 — CID 22690513

IUPAC(2S)-2-amino-N-(2-methoxy-5-methylphenyl)propanamide
SMILESCOc1ccc(C)cc1NC(=O)[C@H](C)N
InChIInChI=1S/C11H16N2O2/c1-7-4-5-10(15-3)9(6-7)13-11(14)8(2)12/h4-6,8H,12H2,1-3H3,(H,13,14)/t8-/m0/s1
InChIKeyISJFYXPBYVJADR-QMMMGPOBSA-N
MW208.26 g/mol
LogP1.29
Rot. Bonds3

About (2S)-2-amino-N-(2-methoxy-5-methylphenyl)propanamide

(2S)-2-amino-N-(2-methoxy-5-methylphenyl)propanamide (PubChem CID 22690513) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is (2S)-2-amino-N-(2-methoxy-5-methylphenyl)propanamide.

Molecular Properties

Compound Name(2S)-2-amino-N-(2-methoxy-5-methylphenyl)propanamide
PubChem CID22690513
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name(2S)-2-amino-N-(2-methoxy-5-methylphenyl)propanamide
SMILESCOc1ccc(C)cc1NC(=O)[C@H](C)N
InChIInChI=1S/C11H16N2O2/c1-7-4-5-10(15-3)9(6-7)13-11(14)8(2)12/h4-6,8H,12H2,1-3H3,(H,13,14)/t8-/m0/s1
InChIKeyISJFYXPBYVJADR-QMMMGPOBSA-N
XLogP1.29
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (2S)-2-amino-N-(2-methoxy-5-methylphenyl)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-methoxy-5-methylphenyl)-3,3-dimethylbutanamide
CID 61149030
2-amino-N-(2-methoxy-5-methylphenyl)-4-methylpentanamide
CID 24690909
(2S)-2-amino-N-(5-chloro-2-methoxyphenyl)propanamide;hydrochloride
CID 119262144
2-amino-N-(5-tert-butyl-2-methoxyphenyl)propanamide
CID 43424856
(2S)-2-amino-N-(5-bromo-2-methoxyphenyl)propanamide;hydrochloride
CID 119292528
N-(5-acetamido-2-methoxyphenyl)-2-aminopropanamide;hydrochloride
CID 119266368
(2R)-2-acetamido-N-(2-methoxy-5-methylphenyl)-3-methylbutanamide
CID 40917712
ethane;(2-methoxy-5-methylphenyl)urea
CID 142042876
[1-(2-methoxy-5-methylanilino)-1-oxopropan-2-yl] 2-methylbutanoate
CID 46512010
(2R)-2-amino-N-(2-bromo-5-methylphenyl)propanamide
CID 82757390
2-amino-N-(2-hydroxy-5-methylphenyl)propanamide;hydrochloride
CID 159728581
(2R)-2-amino-N-(4,5-dimethoxy-2-methylphenyl)propanamide
CID 54996224

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-(2-methoxy-5-methylphenyl)propanamide?
The IUPAC name of (2S)-2-amino-N-(2-methoxy-5-methylphenyl)propanamide (CID 22690513) is (2S)-2-amino-N-(2-methoxy-5-methylphenyl)propanamide.
What is the SMILES notation for (2S)-2-amino-N-(2-methoxy-5-methylphenyl)propanamide?
The canonical SMILES for (2S)-2-amino-N-(2-methoxy-5-methylphenyl)propanamide is COc1ccc(C)cc1NC(=O)[C@H](C)N.
What is the InChIKey of (2S)-2-amino-N-(2-methoxy-5-methylphenyl)propanamide?
The InChIKey is ISJFYXPBYVJADR-QMMMGPOBSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-7-4-5-10(15-3)9(6-7)13-11(14)8(2)12/h4-6,8H,12H2,1-3H3,(H,13,14)/t8-/m0/s1.
What are the key properties of (2S)-2-amino-N-(2-methoxy-5-methylphenyl)propanamide?
(2S)-2-amino-N-(2-methoxy-5-methylphenyl)propanamide has a molecular weight of 208.26 g/mol, XLogP of 1.29, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-(2-methoxy-5-methylphenyl)propanamide is sourced from PubChem (CID 22690513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).