N-[4-methyl-1-(naphthalen-2-ylamino)-1-oxopentan-2-yl]benzamide

C23H24N2O2 — CID 3024355

IUPACN-[4-methyl-1-(naphthalen-2-ylamino)-1-oxopentan-2-yl]benzamide
SMILESCC(C)CC(NC(=O)c1ccccc1)C(=O)Nc1ccc2ccccc2c1
InChIInChI=1S/C23H24N2O2/c1-16(2)14-21(25-22(26)18-9-4-3-5-10-18)23(27)24-20-13-12-17-8-6-7-11-19(17)15-20/h3-13,15-16,21H,14H2,1-2H3,(H,24,27)(H,25,26)
InChIKeyQTJKADZPYFJSEQ-UHFFFAOYSA-N
MW360.46 g/mol
LogP4.62
Rot. Bonds6

About N-[4-methyl-1-(naphthalen-2-ylamino)-1-oxopentan-2-yl]benzamide

N-[4-methyl-1-(naphthalen-2-ylamino)-1-oxopentan-2-yl]benzamide (PubChem CID 3024355) has the molecular formula C23H24N2O2 and a molecular weight of 360.46 g/mol. Its IUPAC name is N-[4-methyl-1-(naphthalen-2-ylamino)-1-oxopentan-2-yl]benzamide.

Molecular Properties

Compound NameN-[4-methyl-1-(naphthalen-2-ylamino)-1-oxopentan-2-yl]benzamide
PubChem CID3024355
Molecular FormulaC23H24N2O2
Molecular Weight360.46 g/mol
Exact Mass360.18
IUPAC NameN-[4-methyl-1-(naphthalen-2-ylamino)-1-oxopentan-2-yl]benzamide
SMILESCC(C)CC(NC(=O)c1ccccc1)C(=O)Nc1ccc2ccccc2c1
InChIInChI=1S/C23H24N2O2/c1-16(2)14-21(25-22(26)18-9-4-3-5-10-18)23(27)24-20-13-12-17-8-6-7-11-19(17)15-20/h3-13,15-16,21H,14H2,1-2H3,(H,24,27)(H,25,26)
InChIKeyQTJKADZPYFJSEQ-UHFFFAOYSA-N
XLogP4.62
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.46
LogP ≤ 54.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2,4-dimethyl-N-naphthalen-2-ylpentanamide
CID 58642005
N-[(2R)-1-anilino-4-methyl-1-oxopentan-2-yl]-4-chlorobenzamide
CID 40701331
2-[(4-benzamidobenzoyl)amino]-4-methylpentanoic acid
CID 119188161
2-amino-4-methyl-N-naphthalen-2-ylpentanamide chloride
CID 5351894
4-methyl-N-[4-methylsulfanyl-1-(naphthalen-2-ylamino)-1-oxobutan-2-yl]benzamide
CID 51065900
benzyl N-[2-[[2-[[(2R)-4-methyl-1-(naphthalen-2-ylamino)-1-oxopentan-2-yl]amino]-2-oxoethyl]amino]-2-oxoethyl]carbamate
CID 129361447
N-[(2S)-4-methyl-1-oxo-1-[(4-phenyl-1,3-thiazol-2-yl)amino]pentan-2-yl]benzamide
CID 139386620
4-methyl-2-[[4-(phenylcarbamoyl)benzoyl]amino]pentanoic acid
CID 120516103
4-chloro-N-[(2R)-1-(3-fluoroanilino)-4-methyl-1-oxopentan-2-yl]benzamide
CID 9412555
N-naphthalen-2-yl-4-phenylbenzamide
CID 1228216
2-(1,3-dioxoisoindol-2-yl)-4-methyl-N-naphthalen-2-ylpentanamide
CID 4070544
(2S)-2-[[(2R)-2-benzamido-3-naphthalen-2-ylpropanoyl]amino]propanoic acid
CID 71136157

Frequently Asked Questions

What is the IUPAC name of N-[4-methyl-1-(naphthalen-2-ylamino)-1-oxopentan-2-yl]benzamide?
The IUPAC name of N-[4-methyl-1-(naphthalen-2-ylamino)-1-oxopentan-2-yl]benzamide (CID 3024355) is N-[4-methyl-1-(naphthalen-2-ylamino)-1-oxopentan-2-yl]benzamide.
What is the SMILES notation for N-[4-methyl-1-(naphthalen-2-ylamino)-1-oxopentan-2-yl]benzamide?
The canonical SMILES for N-[4-methyl-1-(naphthalen-2-ylamino)-1-oxopentan-2-yl]benzamide is CC(C)CC(NC(=O)c1ccccc1)C(=O)Nc1ccc2ccccc2c1.
What is the InChIKey of N-[4-methyl-1-(naphthalen-2-ylamino)-1-oxopentan-2-yl]benzamide?
The InChIKey is QTJKADZPYFJSEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O2/c1-16(2)14-21(25-22(26)18-9-4-3-5-10-18)23(27)24-20-13-12-17-8-6-7-11-19(17)15-20/h3-13,15-16,21H,14H2,1-2H3,(H,24,27)(H,25,26).
What are the key properties of N-[4-methyl-1-(naphthalen-2-ylamino)-1-oxopentan-2-yl]benzamide?
N-[4-methyl-1-(naphthalen-2-ylamino)-1-oxopentan-2-yl]benzamide has a molecular weight of 360.46 g/mol, XLogP of 4.62, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-methyl-1-(naphthalen-2-ylamino)-1-oxopentan-2-yl]benzamide is sourced from PubChem (CID 3024355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).