N-(2-acetamidophenyl)-2,2-dicyclohexylacetamide

C22H32N2O2 — CID 11175727

IUPACN-(2-acetamidophenyl)-2,2-dicyclohexylacetamide
SMILESCC(=O)Nc1ccccc1NC(=O)C(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C22H32N2O2/c1-16(25)23-19-14-8-9-15-20(19)24-22(26)21(17-10-4-2-5-11-17)18-12-6-3-7-13-18/h8-9,14-15,17-18,21H,2-7,10-13H2,1H3,(H,23,25)(H,24,26)
InChIKeyHBMDHEAJTIROOK-UHFFFAOYSA-N
MW356.51 g/mol
LogP5.36
Rot. Bonds5

About N-(2-acetamidophenyl)-2,2-dicyclohexylacetamide

N-(2-acetamidophenyl)-2,2-dicyclohexylacetamide (PubChem CID 11175727) has the molecular formula C22H32N2O2 and a molecular weight of 356.51 g/mol. Its IUPAC name is N-(2-acetamidophenyl)-2,2-dicyclohexylacetamide.

Molecular Properties

Compound NameN-(2-acetamidophenyl)-2,2-dicyclohexylacetamide
PubChem CID11175727
Molecular FormulaC22H32N2O2
Molecular Weight356.51 g/mol
Exact Mass356.25
IUPAC NameN-(2-acetamidophenyl)-2,2-dicyclohexylacetamide
SMILESCC(=O)Nc1ccccc1NC(=O)C(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C22H32N2O2/c1-16(25)23-19-14-8-9-15-20(19)24-22(26)21(17-10-4-2-5-11-17)18-12-6-3-7-13-18/h8-9,14-15,17-18,21H,2-7,10-13H2,1H3,(H,23,25)(H,24,26)
InChIKeyHBMDHEAJTIROOK-UHFFFAOYSA-N
XLogP5.36
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500356.51
LogP ≤ 55.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(cyclohexylcarbamoylamino)phenyl]acetamide
CID 113093681
2-acetamido-2-cyclopentyl-N-(2-methylphenyl)acetamide
CID 47126825
N-[2-(1-bromoethyl)phenyl]-2,2-dicyclopropylacetamide
CID 112745152
N-[2-[(cyclohexylamino)methyl]phenyl]acetamide
CID 66289861
N-[2-[(1-cyclohexylpropylamino)methyl]phenyl]acetamide
CID 66419635
N-[2-[[[(1R)-1-cyclopentylethyl]amino]methyl]phenyl]acetamide
CID 81394935
2-acetamido-N-(2-chlorophenyl)-2-cyclopentylacetamide
CID 42885299
(2R)-2-(2-acetamidophenoxy)-N-cyclohexylpropanamide
CID 9111099
(2R)-N-(2-acetylphenyl)-2-(cyclooctylamino)propanamide
CID 9444335
2-acetamido-2-cyclopentyl-N-(2,3-dichlorophenyl)acetamide
CID 51272483
N-(2-acetamidophenyl)-3-cyclopentylpropanamide
CID 976246
(2R)-2-acetamido-2-cyclopentyl-N-(2-ethoxyphenyl)acetamide
CID 40938974

Frequently Asked Questions

What is the IUPAC name of N-(2-acetamidophenyl)-2,2-dicyclohexylacetamide?
The IUPAC name of N-(2-acetamidophenyl)-2,2-dicyclohexylacetamide (CID 11175727) is N-(2-acetamidophenyl)-2,2-dicyclohexylacetamide.
What is the SMILES notation for N-(2-acetamidophenyl)-2,2-dicyclohexylacetamide?
The canonical SMILES for N-(2-acetamidophenyl)-2,2-dicyclohexylacetamide is CC(=O)Nc1ccccc1NC(=O)C(C1CCCCC1)C1CCCCC1.
What is the InChIKey of N-(2-acetamidophenyl)-2,2-dicyclohexylacetamide?
The InChIKey is HBMDHEAJTIROOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H32N2O2/c1-16(25)23-19-14-8-9-15-20(19)24-22(26)21(17-10-4-2-5-11-17)18-12-6-3-7-13-18/h8-9,14-15,17-18,21H,2-7,10-13H2,1H3,(H,23,25)(H,24,26).
What are the key properties of N-(2-acetamidophenyl)-2,2-dicyclohexylacetamide?
N-(2-acetamidophenyl)-2,2-dicyclohexylacetamide has a molecular weight of 356.51 g/mol, XLogP of 5.36, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-acetamidophenyl)-2,2-dicyclohexylacetamide is sourced from PubChem (CID 11175727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).