ethane;2-(4-phenylcyclohexyl)-N-(4-phenylphenyl)acetamide

C28H33NO — CID 145078209

IUPACethane;2-(4-phenylcyclohexyl)-N-(4-phenylphenyl)acetamide
SMILESCC.O=C(CC1CCC(c2ccccc2)CC1)Nc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C26H27NO.C2H6/c28-26(19-20-11-13-23(14-12-20)21-7-3-1-4-8-21)27-25-17-15-24(16-18-25)22-9-5-2-6-10-22;1-2/h1-10,15-18,20,23H,11-14,19H2,(H,27,28);1-2H3
InChIKeyXBOSLFLIHWZDDT-UHFFFAOYSA-N
MW399.58 g/mol
LogP7.68
Rot. Bonds5

About ethane;2-(4-phenylcyclohexyl)-N-(4-phenylphenyl)acetamide

ethane;2-(4-phenylcyclohexyl)-N-(4-phenylphenyl)acetamide (PubChem CID 145078209) has the molecular formula C28H33NO and a molecular weight of 399.58 g/mol. Its IUPAC name is ethane;2-(4-phenylcyclohexyl)-N-(4-phenylphenyl)acetamide.

Molecular Properties

Compound Nameethane;2-(4-phenylcyclohexyl)-N-(4-phenylphenyl)acetamide
PubChem CID145078209
Molecular FormulaC28H33NO
Molecular Weight399.58 g/mol
Exact Mass399.26
IUPAC Nameethane;2-(4-phenylcyclohexyl)-N-(4-phenylphenyl)acetamide
SMILESCC.O=C(CC1CCC(c2ccccc2)CC1)Nc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C26H27NO.C2H6/c28-26(19-20-11-13-23(14-12-20)21-7-3-1-4-8-21)27-25-17-15-24(16-18-25)22-9-5-2-6-10-22;1-2/h1-10,15-18,20,23H,11-14,19H2,(H,27,28);1-2H3
InChIKeyXBOSLFLIHWZDDT-UHFFFAOYSA-N
XLogP7.68
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500399.58
LogP ≤ 57.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[4-(hydroxymethyl)phenyl]-2-(4-phenylcyclohexyl)acetamide
CID 121325134
2-cyclopropyl-N-phenylacetamide
CID 60753326
N-(4-phenylphenyl)-2-piperidin-4-ylacetamide
CID 67362104
N-(4-cyanophenyl)-2-[(1R,3S)-3-phenylcyclopentyl]acetamide
CID 121324973
N-(4-chlorophenyl)-2-[4-(3-methylphenyl)cyclohexyl]acetamide
CID 161440636
2-methyl-3-[[2-(4-phenylcyclohexyl)acetyl]amino]propanoic acid
CID 119237415
N-(4-cyclopropylphenyl)-4-phenylbenzamide
CID 123874228
3-[4-[2-(4-chloroanilino)-2-oxoethyl]cyclohexyl]benzoic acid
CID 121319777
N-(2,3-difluorophenyl)-2-(4-phenylcyclohexyl)acetamide
CID 174866386
N-(4-chlorophenyl)-2-[4-(4-ethoxyphenyl)cyclohexyl]acetamide
CID 121325219
2-cyclopropyl-N-(4-sulfanylphenyl)acetamide
CID 68600520
2-cyclohexyl-N-(3-phenylphenyl)acetamide
CID 53348155

Frequently Asked Questions

What is the IUPAC name of ethane;2-(4-phenylcyclohexyl)-N-(4-phenylphenyl)acetamide?
The IUPAC name of ethane;2-(4-phenylcyclohexyl)-N-(4-phenylphenyl)acetamide (CID 145078209) is ethane;2-(4-phenylcyclohexyl)-N-(4-phenylphenyl)acetamide.
What is the SMILES notation for ethane;2-(4-phenylcyclohexyl)-N-(4-phenylphenyl)acetamide?
The canonical SMILES for ethane;2-(4-phenylcyclohexyl)-N-(4-phenylphenyl)acetamide is CC.O=C(CC1CCC(c2ccccc2)CC1)Nc1ccc(-c2ccccc2)cc1.
What is the InChIKey of ethane;2-(4-phenylcyclohexyl)-N-(4-phenylphenyl)acetamide?
The InChIKey is XBOSLFLIHWZDDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H27NO.C2H6/c28-26(19-20-11-13-23(14-12-20)21-7-3-1-4-8-21)27-25-17-15-24(16-18-25)22-9-5-2-6-10-22;1-2/h1-10,15-18,20,23H,11-14,19H2,(H,27,28);1-2H3.
What are the key properties of ethane;2-(4-phenylcyclohexyl)-N-(4-phenylphenyl)acetamide?
ethane;2-(4-phenylcyclohexyl)-N-(4-phenylphenyl)acetamide has a molecular weight of 399.58 g/mol, XLogP of 7.68, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-(4-phenylcyclohexyl)-N-(4-phenylphenyl)acetamide is sourced from PubChem (CID 145078209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).