2-N,2-N-dicyclohexyl-4-phenylnaphthalene-2,6-dicarboxamide

C30H34N2O2 — CID 175092340

IUPAC2-N,2-N-dicyclohexyl-4-phenylnaphthalene-2,6-dicarboxamide
SMILESNC(=O)c1ccc2cc(C(=O)N(C3CCCCC3)C3CCCCC3)cc(-c3ccccc3)c2c1
InChIInChI=1S/C30H34N2O2/c31-29(33)23-17-16-22-18-24(20-27(28(22)19-23)21-10-4-1-5-11-21)30(34)32(25-12-6-2-7-13-25)26-14-8-3-9-15-26/h1,4-5,10-11,16-20,25-26H,2-3,6-9,12-15H2,(H2,31,33)
InChIKeyZAMVBSLFPACQCH-UHFFFAOYSA-N
MW454.61 g/mol
LogP6.71
Rot. Bonds5

About 2-N,2-N-dicyclohexyl-4-phenylnaphthalene-2,6-dicarboxamide

2-N,2-N-dicyclohexyl-4-phenylnaphthalene-2,6-dicarboxamide (PubChem CID 175092340) has the molecular formula C30H34N2O2 and a molecular weight of 454.61 g/mol. Its IUPAC name is 2-N,2-N-dicyclohexyl-4-phenylnaphthalene-2,6-dicarboxamide.

Molecular Properties

Compound Name2-N,2-N-dicyclohexyl-4-phenylnaphthalene-2,6-dicarboxamide
PubChem CID175092340
Molecular FormulaC30H34N2O2
Molecular Weight454.61 g/mol
Exact Mass454.26
IUPAC Name2-N,2-N-dicyclohexyl-4-phenylnaphthalene-2,6-dicarboxamide
SMILESNC(=O)c1ccc2cc(C(=O)N(C3CCCCC3)C3CCCCC3)cc(-c3ccccc3)c2c1
InChIInChI=1S/C30H34N2O2/c31-29(33)23-17-16-22-18-24(20-27(28(22)19-23)21-10-4-1-5-11-21)30(34)32(25-12-6-2-7-13-25)26-14-8-3-9-15-26/h1,4-5,10-11,16-20,25-26H,2-3,6-9,12-15H2,(H2,31,33)
InChIKeyZAMVBSLFPACQCH-UHFFFAOYSA-N
XLogP6.71
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500454.61
LogP ≤ 56.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[4-(5-carbamoyl-2-phenylphenyl)phenyl]-4-phenylbenzamide
CID 141346150
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CID 3554949
2-methyl-4-(2-phenylphenyl)quinoline-6-carboxamide
CID 167445709
4-bromo-N-cyclohexyl-N-cyclopentylbenzamide
CID 19754888
N,N-dicyclohexyl-4-fluorobenzamide
CID 784952
N-[3-(3-carbamoylphenyl)phenyl]-N-cyclohexylcarbamate
CID 71302923
anthracen-9-yl N,N-dicyclohexylcarbamate
CID 118876176
4-(1H-benzimidazol-2-yl)-N,N-dicyclohexylbenzamide
CID 3572138
4-N,4-N-dicyclohexyl-1-N-(1-phenylcyclopropyl)benzene-1,4-dicarboxamide
CID 3923780
benzamide;3-cyclopentyloxy-4-methoxybenzamide
CID 18691056
3-[cyclopentyl(methyl)amino]benzamide
CID 66960912
N-cyclohexyl-N-cyclopropyl-3-phosphanylbenzamide
CID 143724449

Frequently Asked Questions

What is the IUPAC name of 2-N,2-N-dicyclohexyl-4-phenylnaphthalene-2,6-dicarboxamide?
The IUPAC name of 2-N,2-N-dicyclohexyl-4-phenylnaphthalene-2,6-dicarboxamide (CID 175092340) is 2-N,2-N-dicyclohexyl-4-phenylnaphthalene-2,6-dicarboxamide.
What is the SMILES notation for 2-N,2-N-dicyclohexyl-4-phenylnaphthalene-2,6-dicarboxamide?
The canonical SMILES for 2-N,2-N-dicyclohexyl-4-phenylnaphthalene-2,6-dicarboxamide is NC(=O)c1ccc2cc(C(=O)N(C3CCCCC3)C3CCCCC3)cc(-c3ccccc3)c2c1.
What is the InChIKey of 2-N,2-N-dicyclohexyl-4-phenylnaphthalene-2,6-dicarboxamide?
The InChIKey is ZAMVBSLFPACQCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H34N2O2/c31-29(33)23-17-16-22-18-24(20-27(28(22)19-23)21-10-4-1-5-11-21)30(34)32(25-12-6-2-7-13-25)26-14-8-3-9-15-26/h1,4-5,10-11,16-20,25-26H,2-3,6-9,12-15H2,(H2,31,33).
What are the key properties of 2-N,2-N-dicyclohexyl-4-phenylnaphthalene-2,6-dicarboxamide?
2-N,2-N-dicyclohexyl-4-phenylnaphthalene-2,6-dicarboxamide has a molecular weight of 454.61 g/mol, XLogP of 6.71, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N-dicyclohexyl-4-phenylnaphthalene-2,6-dicarboxamide is sourced from PubChem (CID 175092340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).