N-[(1R)-1-(4-ethylphenyl)-2-methylpropyl]naphthalene-2-carboxamide

C23H25NO — CID 7671180

IUPACN-[(1R)-1-(4-ethylphenyl)-2-methylpropyl]naphthalene-2-carboxamide
SMILESCCc1ccc([C@H](NC(=O)c2ccc3ccccc3c2)C(C)C)cc1
InChIInChI=1S/C23H25NO/c1-4-17-9-11-19(12-10-17)22(16(2)3)24-23(25)21-14-13-18-7-5-6-8-20(18)15-21/h5-16,22H,4H2,1-3H3,(H,24,25)/t22-/m1/s1
InChIKeyHJJXYJDGWUVHIF-JOCHJYFZSA-N
MW331.46 g/mol
LogP5.53
Rot. Bonds5

About N-[(1R)-1-(4-ethylphenyl)-2-methylpropyl]naphthalene-2-carboxamide

N-[(1R)-1-(4-ethylphenyl)-2-methylpropyl]naphthalene-2-carboxamide (PubChem CID 7671180) has the molecular formula C23H25NO and a molecular weight of 331.46 g/mol. Its IUPAC name is N-[(1R)-1-(4-ethylphenyl)-2-methylpropyl]naphthalene-2-carboxamide.

Molecular Properties

Compound NameN-[(1R)-1-(4-ethylphenyl)-2-methylpropyl]naphthalene-2-carboxamide
PubChem CID7671180
Molecular FormulaC23H25NO
Molecular Weight331.46 g/mol
Exact Mass331.19
IUPAC NameN-[(1R)-1-(4-ethylphenyl)-2-methylpropyl]naphthalene-2-carboxamide
SMILESCCc1ccc([C@H](NC(=O)c2ccc3ccccc3c2)C(C)C)cc1
InChIInChI=1S/C23H25NO/c1-4-17-9-11-19(12-10-17)22(16(2)3)24-23(25)21-14-13-18-7-5-6-8-20(18)15-21/h5-16,22H,4H2,1-3H3,(H,24,25)/t22-/m1/s1
InChIKeyHJJXYJDGWUVHIF-JOCHJYFZSA-N
XLogP5.53
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500331.46
LogP ≤ 55.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-cyano-N-[1-(4-ethylphenyl)-2-methylpropyl]benzamide
CID 17444680
N-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylpropyl]naphthalene-2-carboxamide
CID 7669638
N-pentan-2-ylnaphthalene-2-carboxamide
CID 15622075
4-(difluoromethoxy)-N-[1-(4-ethylphenyl)-2-methylpropyl]-3-methoxybenzamide
CID 18276449
N-[(1R)-1-phenylethyl]naphthalene-2-carboxamide
CID 814202
N-[1-(4-ethylphenyl)-2-methylpropyl]-3-methoxy-4-[2-(4-methoxyanilino)-2-oxoethoxy]benzamide
CID 16563652
N-[(1R)-1-(4-ethylphenyl)-2-methylpropyl]-2,2-diphenylacetamide
CID 7671231
N-[1-(4-ethylphenyl)-2-methylpropyl]-9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxamide
CID 45355620
N-[2-[[1-(4-ethylphenyl)-2-methylpropyl]amino]-2-oxoethyl]-2-phenylacetamide
CID 55437912
N-(1-bromopropan-2-yl)naphthalene-2-carboxamide
CID 114310701
4-ethyl-N-naphthalen-2-ylbenzamide
CID 5108081
[(2S)-1-(4-ethylphenyl)-1-oxopropan-2-yl] naphthalene-2-carboxylate
CID 7698131

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-(4-ethylphenyl)-2-methylpropyl]naphthalene-2-carboxamide?
The IUPAC name of N-[(1R)-1-(4-ethylphenyl)-2-methylpropyl]naphthalene-2-carboxamide (CID 7671180) is N-[(1R)-1-(4-ethylphenyl)-2-methylpropyl]naphthalene-2-carboxamide.
What is the SMILES notation for N-[(1R)-1-(4-ethylphenyl)-2-methylpropyl]naphthalene-2-carboxamide?
The canonical SMILES for N-[(1R)-1-(4-ethylphenyl)-2-methylpropyl]naphthalene-2-carboxamide is CCc1ccc([C@H](NC(=O)c2ccc3ccccc3c2)C(C)C)cc1.
What is the InChIKey of N-[(1R)-1-(4-ethylphenyl)-2-methylpropyl]naphthalene-2-carboxamide?
The InChIKey is HJJXYJDGWUVHIF-JOCHJYFZSA-N. The full InChI is InChI=1S/C23H25NO/c1-4-17-9-11-19(12-10-17)22(16(2)3)24-23(25)21-14-13-18-7-5-6-8-20(18)15-21/h5-16,22H,4H2,1-3H3,(H,24,25)/t22-/m1/s1.
What are the key properties of N-[(1R)-1-(4-ethylphenyl)-2-methylpropyl]naphthalene-2-carboxamide?
N-[(1R)-1-(4-ethylphenyl)-2-methylpropyl]naphthalene-2-carboxamide has a molecular weight of 331.46 g/mol, XLogP of 5.53, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-(4-ethylphenyl)-2-methylpropyl]naphthalene-2-carboxamide is sourced from PubChem (CID 7671180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).