2-(N-acetyl-4-phenylmethoxyanilino)-N-cyclohexylacetamide

C23H28N2O3 — CID 113177523

IUPAC2-(N-acetyl-4-phenylmethoxyanilino)-N-cyclohexylacetamide
SMILESCC(=O)N(CC(=O)NC1CCCCC1)c1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C23H28N2O3/c1-18(26)25(16-23(27)24-20-10-6-3-7-11-20)21-12-14-22(15-13-21)28-17-19-8-4-2-5-9-19/h2,4-5,8-9,12-15,20H,3,6-7,10-11,16-17H2,1H3,(H,24,27)
InChIKeyCDOYOWBCQRNNCV-UHFFFAOYSA-N
MW380.49 g/mol
LogP4.07
Rot. Bonds7

About 2-(N-acetyl-4-phenylmethoxyanilino)-N-cyclohexylacetamide

2-(N-acetyl-4-phenylmethoxyanilino)-N-cyclohexylacetamide (PubChem CID 113177523) has the molecular formula C23H28N2O3 and a molecular weight of 380.49 g/mol. Its IUPAC name is 2-(N-acetyl-4-phenylmethoxyanilino)-N-cyclohexylacetamide.

Molecular Properties

Compound Name2-(N-acetyl-4-phenylmethoxyanilino)-N-cyclohexylacetamide
PubChem CID113177523
Molecular FormulaC23H28N2O3
Molecular Weight380.49 g/mol
Exact Mass380.21
IUPAC Name2-(N-acetyl-4-phenylmethoxyanilino)-N-cyclohexylacetamide
SMILESCC(=O)N(CC(=O)NC1CCCCC1)c1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C23H28N2O3/c1-18(26)25(16-23(27)24-20-10-6-3-7-11-20)21-12-14-22(15-13-21)28-17-19-8-4-2-5-9-19/h2,4-5,8-9,12-15,20H,3,6-7,10-11,16-17H2,1H3,(H,24,27)
InChIKeyCDOYOWBCQRNNCV-UHFFFAOYSA-N
XLogP4.07
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.49
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(N-acetylanilino)-N-cyclopentylacetamide
CID 113167073
2-(N-acetyl-4-ethylanilino)-N-cycloheptylacetamide
CID 113169281
2-(N-acetyl-4-phenylmethoxyanilino)-N-pentylacetamide
CID 113177543
2-(N-acetyl-3-methoxyanilino)-N-cycloheptylacetamide
CID 113173369
3-(N-acetylanilino)-N-cyclohexylpropanamide
CID 113123341
2-(N-acetyl-2-phenoxyanilino)-N-cycloheptylacetamide
CID 113179225
2-(N-acetyl-3,4-dimethylanilino)-N-cyclohexylacetamide
CID 113168245
2-(N-acetyl-4-phenylmethoxyanilino)-N-(4-cyanophenyl)acetamide
CID 113177559
2-[acetyl(cyclopentyl)amino]-N-(4-phenylmethoxyphenyl)acetamide
CID 113159367
N-cyclohexyl-2-(N,3-diacetylanilino)acetamide
CID 113175380
methyl 3-[acetyl-[2-(cycloheptylamino)-2-oxoethyl]amino]benzoate
CID 113176252
2-(N-acetyl-3-chloro-4-methylanilino)-N-cycloheptylacetamide
CID 113172228

Frequently Asked Questions

What is the IUPAC name of 2-(N-acetyl-4-phenylmethoxyanilino)-N-cyclohexylacetamide?
The IUPAC name of 2-(N-acetyl-4-phenylmethoxyanilino)-N-cyclohexylacetamide (CID 113177523) is 2-(N-acetyl-4-phenylmethoxyanilino)-N-cyclohexylacetamide.
What is the SMILES notation for 2-(N-acetyl-4-phenylmethoxyanilino)-N-cyclohexylacetamide?
The canonical SMILES for 2-(N-acetyl-4-phenylmethoxyanilino)-N-cyclohexylacetamide is CC(=O)N(CC(=O)NC1CCCCC1)c1ccc(OCc2ccccc2)cc1.
What is the InChIKey of 2-(N-acetyl-4-phenylmethoxyanilino)-N-cyclohexylacetamide?
The InChIKey is CDOYOWBCQRNNCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N2O3/c1-18(26)25(16-23(27)24-20-10-6-3-7-11-20)21-12-14-22(15-13-21)28-17-19-8-4-2-5-9-19/h2,4-5,8-9,12-15,20H,3,6-7,10-11,16-17H2,1H3,(H,24,27).
What are the key properties of 2-(N-acetyl-4-phenylmethoxyanilino)-N-cyclohexylacetamide?
2-(N-acetyl-4-phenylmethoxyanilino)-N-cyclohexylacetamide has a molecular weight of 380.49 g/mol, XLogP of 4.07, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-acetyl-4-phenylmethoxyanilino)-N-cyclohexylacetamide is sourced from PubChem (CID 113177523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).