(2R)-N-carbamoyl-2-[methyl(3-naphthalen-2-ylpropanoyl)amino]-3-phenylpropanamide

C24H25N3O3 — CID 173291028

IUPAC(2R)-N-carbamoyl-2-[methyl(3-naphthalen-2-ylpropanoyl)amino]-3-phenylpropanamide
SMILESCN(C(=O)CCc1ccc2ccccc2c1)[C@H](Cc1ccccc1)C(=O)NC(N)=O
InChIInChI=1S/C24H25N3O3/c1-27(21(23(29)26-24(25)30)16-17-7-3-2-4-8-17)22(28)14-12-18-11-13-19-9-5-6-10-20(19)15-18/h2-11,13,15,21H,12,14,16H2,1H3,(H3,25,26,29,30)/t21-/m1/s1
InChIKeyVEXNOFKOIUNYLL-OAQYLSRUSA-N
MW403.48 g/mol
LogP3.04
Rot. Bonds7

About (2R)-N-carbamoyl-2-[methyl(3-naphthalen-2-ylpropanoyl)amino]-3-phenylpropanamide

(2R)-N-carbamoyl-2-[methyl(3-naphthalen-2-ylpropanoyl)amino]-3-phenylpropanamide (PubChem CID 173291028) has the molecular formula C24H25N3O3 and a molecular weight of 403.48 g/mol. Its IUPAC name is (2R)-N-carbamoyl-2-[methyl(3-naphthalen-2-ylpropanoyl)amino]-3-phenylpropanamide.

Molecular Properties

Compound Name(2R)-N-carbamoyl-2-[methyl(3-naphthalen-2-ylpropanoyl)amino]-3-phenylpropanamide
PubChem CID173291028
Molecular FormulaC24H25N3O3
Molecular Weight403.48 g/mol
Exact Mass403.19
IUPAC Name(2R)-N-carbamoyl-2-[methyl(3-naphthalen-2-ylpropanoyl)amino]-3-phenylpropanamide
SMILESCN(C(=O)CCc1ccc2ccccc2c1)[C@H](Cc1ccccc1)C(=O)NC(N)=O
InChIInChI=1S/C24H25N3O3/c1-27(21(23(29)26-24(25)30)16-17-7-3-2-4-8-17)22(28)14-12-18-11-13-19-9-5-6-10-20(19)15-18/h2-11,13,15,21H,12,14,16H2,1H3,(H3,25,26,29,30)/t21-/m1/s1
InChIKeyVEXNOFKOIUNYLL-OAQYLSRUSA-N
XLogP3.04
TPSA92.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.48
LogP ≤ 53.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-3-naphthalen-2-yl-N-(1-phenylethyl)propanamide
CID 60521214
N-(1-aminopropan-2-yl)-N-methyl-3-naphthalen-2-ylpropanamide;hydrochloride
CID 119584639
N-methyl-2-[methyl-[2-(methylamino)-3-naphthalen-2-ylpropanoyl]amino]-3-phenylpropanamide
CID 22326951
[1-[[1-(2-acetylhydrazinyl)-1-oxo-3-phenylpropan-2-yl]-methylamino]-3-naphthalen-2-yl-1-oxopropan-2-yl]-methylcarbamic acid
CID 18704630
2-[[(2R)-2-[[2-(2-aminobutoxy)acetyl]-methylamino]-3-naphthalen-2-ylpropanoyl]-methylamino]-N-methyl-3-phenylpropanamide
CID 67724345
5-[(1R)-1-[methyl(3-naphthalen-2-ylpropanoyl)amino]-2-naphthalen-2-ylethyl]-1,2,4-oxadiazole-3-carboxamide
CID 22949320
2-aminoethyl N-methyl-N-[(2R)-3-naphthalen-2-yl-1-(2-naphthalen-2-ylethylamino)-1-oxopropan-2-yl]carbamate
CID 59081959
2-[acetyl(methyl)amino]-3-naphthalen-2-ylpropanoic acid
CID 150245391
N-[1-(2-acetyl-2-methylhydrazinyl)-1-oxo-3-phenylpropan-2-yl]-N-methyl-2-(methylamino)-3-naphthalen-2-ylpropanamide
CID 18704633
(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-(3,5-dihydroxyphenyl)propanoyl]amino]-3-naphthalen-2-ylpropanoyl]-methylamino]-3-phenylpropanoyl]-methylamino]-3-phenylpropanoyl]-methylamino]-3-phenylpropanamide
CID 25034055
5-[1-[carbamoyl(3-naphthalen-2-ylpropanoyl)amino]-2-phenylethyl]-N-methyl-1,2,4-oxadiazole-3-carboxamide
CID 18318392
N-methyl-4-naphthalen-2-ylbutanehydrazide
CID 116845183

Frequently Asked Questions

What is the IUPAC name of (2R)-N-carbamoyl-2-[methyl(3-naphthalen-2-ylpropanoyl)amino]-3-phenylpropanamide?
The IUPAC name of (2R)-N-carbamoyl-2-[methyl(3-naphthalen-2-ylpropanoyl)amino]-3-phenylpropanamide (CID 173291028) is (2R)-N-carbamoyl-2-[methyl(3-naphthalen-2-ylpropanoyl)amino]-3-phenylpropanamide.
What is the SMILES notation for (2R)-N-carbamoyl-2-[methyl(3-naphthalen-2-ylpropanoyl)amino]-3-phenylpropanamide?
The canonical SMILES for (2R)-N-carbamoyl-2-[methyl(3-naphthalen-2-ylpropanoyl)amino]-3-phenylpropanamide is CN(C(=O)CCc1ccc2ccccc2c1)[C@H](Cc1ccccc1)C(=O)NC(N)=O.
What is the InChIKey of (2R)-N-carbamoyl-2-[methyl(3-naphthalen-2-ylpropanoyl)amino]-3-phenylpropanamide?
The InChIKey is VEXNOFKOIUNYLL-OAQYLSRUSA-N. The full InChI is InChI=1S/C24H25N3O3/c1-27(21(23(29)26-24(25)30)16-17-7-3-2-4-8-17)22(28)14-12-18-11-13-19-9-5-6-10-20(19)15-18/h2-11,13,15,21H,12,14,16H2,1H3,(H3,25,26,29,30)/t21-/m1/s1.
What are the key properties of (2R)-N-carbamoyl-2-[methyl(3-naphthalen-2-ylpropanoyl)amino]-3-phenylpropanamide?
(2R)-N-carbamoyl-2-[methyl(3-naphthalen-2-ylpropanoyl)amino]-3-phenylpropanamide has a molecular weight of 403.48 g/mol, XLogP of 3.04, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-carbamoyl-2-[methyl(3-naphthalen-2-ylpropanoyl)amino]-3-phenylpropanamide is sourced from PubChem (CID 173291028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).