(2S)-2-(methylamino)-N-(4-methylnaphthalen-2-yl)propanamide

C15H18N2O — CID 174866116

IUPAC(2S)-2-(methylamino)-N-(4-methylnaphthalen-2-yl)propanamide
SMILESCN[C@@H](C)C(=O)Nc1cc(C)c2ccccc2c1
InChIInChI=1S/C15H18N2O/c1-10-8-13(17-15(18)11(2)16-3)9-12-6-4-5-7-14(10)12/h4-9,11,16H,1-3H3,(H,17,18)/t11-/m0/s1
InChIKeyIULOGGBXWSVONQ-NSHDSACASA-N
MW242.32 g/mol
LogP2.69
Rot. Bonds3

About (2S)-2-(methylamino)-N-(4-methylnaphthalen-2-yl)propanamide

(2S)-2-(methylamino)-N-(4-methylnaphthalen-2-yl)propanamide (PubChem CID 174866116) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is (2S)-2-(methylamino)-N-(4-methylnaphthalen-2-yl)propanamide.

Molecular Properties

Compound Name(2S)-2-(methylamino)-N-(4-methylnaphthalen-2-yl)propanamide
PubChem CID174866116
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name(2S)-2-(methylamino)-N-(4-methylnaphthalen-2-yl)propanamide
SMILESCN[C@@H](C)C(=O)Nc1cc(C)c2ccccc2c1
InChIInChI=1S/C15H18N2O/c1-10-8-13(17-15(18)11(2)16-3)9-12-6-4-5-7-14(10)12/h4-9,11,16H,1-3H3,(H,17,18)/t11-/m0/s1
InChIKeyIULOGGBXWSVONQ-NSHDSACASA-N
XLogP2.69
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-bromo-3,5-dimethylphenyl)-2-(methylamino)propanamide
CID 107574214
(2S)-2-(methylamino)-N-phenylpropanamide;hydrochloride
CID 70254304
(2S)-2-(methylamino)-N-(3-methylphenyl)propanamide
CID 59393630
2-(3,4-dimethylanilino)-N-naphthalen-2-ylpropanamide
CID 78666889
N-(3-iodo-4-methylphenyl)-2-(methylamino)propanamide
CID 62637660
[(2R)-1-(4-methylanilino)-1-oxopropan-2-yl] anthracene-9-carboxylate
CID 7786496
5-[2-(methylamino)propanoylamino]benzene-1,3-dicarboxamide
CID 55096712
(2S)-2-(methylamino)-N-pyridin-4-ylpropanamide
CID 59361167
2-(methylamino)-N-(4-propan-2-ylphenyl)propanamide
CID 60638794
(2R)-2-(methylamino)-N-(4-methylnaphthalen-1-yl)sulfonylpropanamide
CID 166291932
2-amino-N-(4-methoxynaphthalen-2-yl)-4-methylpentanamide;hydrochloride
CID 3014281
2-(3-fluoro-4-methylanilino)-N-naphthalen-2-ylpropanamide
CID 78708039

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(methylamino)-N-(4-methylnaphthalen-2-yl)propanamide?
The IUPAC name of (2S)-2-(methylamino)-N-(4-methylnaphthalen-2-yl)propanamide (CID 174866116) is (2S)-2-(methylamino)-N-(4-methylnaphthalen-2-yl)propanamide.
What is the SMILES notation for (2S)-2-(methylamino)-N-(4-methylnaphthalen-2-yl)propanamide?
The canonical SMILES for (2S)-2-(methylamino)-N-(4-methylnaphthalen-2-yl)propanamide is CN[C@@H](C)C(=O)Nc1cc(C)c2ccccc2c1.
What is the InChIKey of (2S)-2-(methylamino)-N-(4-methylnaphthalen-2-yl)propanamide?
The InChIKey is IULOGGBXWSVONQ-NSHDSACASA-N. The full InChI is InChI=1S/C15H18N2O/c1-10-8-13(17-15(18)11(2)16-3)9-12-6-4-5-7-14(10)12/h4-9,11,16H,1-3H3,(H,17,18)/t11-/m0/s1.
What are the key properties of (2S)-2-(methylamino)-N-(4-methylnaphthalen-2-yl)propanamide?
(2S)-2-(methylamino)-N-(4-methylnaphthalen-2-yl)propanamide has a molecular weight of 242.32 g/mol, XLogP of 2.69, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(methylamino)-N-(4-methylnaphthalen-2-yl)propanamide is sourced from PubChem (CID 174866116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).