N-cyclohexyl-2-(4-methoxyphenyl)-2-oxoacetamide

C15H19NO3 — CID 11414317

IUPACN-cyclohexyl-2-(4-methoxyphenyl)-2-oxoacetamide
SMILESCOc1ccc(C(=O)C(=O)NC2CCCCC2)cc1
InChIInChI=1S/C15H19NO3/c1-19-13-9-7-11(8-10-13)14(17)15(18)16-12-5-3-2-4-6-12/h7-10,12H,2-6H2,1H3,(H,16,18)
InChIKeyVVVHAIUYUPTNRM-UHFFFAOYSA-N
MW261.32 g/mol
LogP2.33
Rot. Bonds4

About N-cyclohexyl-2-(4-methoxyphenyl)-2-oxoacetamide

N-cyclohexyl-2-(4-methoxyphenyl)-2-oxoacetamide (PubChem CID 11414317) has the molecular formula C15H19NO3 and a molecular weight of 261.32 g/mol. Its IUPAC name is N-cyclohexyl-2-(4-methoxyphenyl)-2-oxoacetamide.

Molecular Properties

Compound NameN-cyclohexyl-2-(4-methoxyphenyl)-2-oxoacetamide
PubChem CID11414317
Molecular FormulaC15H19NO3
Molecular Weight261.32 g/mol
Exact Mass261.14
IUPAC NameN-cyclohexyl-2-(4-methoxyphenyl)-2-oxoacetamide
SMILESCOc1ccc(C(=O)C(=O)NC2CCCCC2)cc1
InChIInChI=1S/C15H19NO3/c1-19-13-9-7-11(8-10-13)14(17)15(18)16-12-5-3-2-4-6-12/h7-10,12H,2-6H2,1H3,(H,16,18)
InChIKeyVVVHAIUYUPTNRM-UHFFFAOYSA-N
XLogP2.33
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

N-cyclohexyl-2-(4-ethylphenyl)-2-oxoacetamide
CID 82121266
[2-(cycloheptylamino)-2-oxoethyl] 4-methoxybenzoate
CID 2376879
N-cyclohexyl-2-oxo-2-phenylacetamide
CID 11436176
2-(4-tert-butylphenyl)-N-cyclopentyl-2-oxoacetamide
CID 47418183
[(2R)-1-(cyclopentylamino)-1-oxopropan-2-yl] 4-methoxybenzoate
CID 7506979
(E)-N-cyclopropyl-3-(4-methoxyphenyl)-2-methylbut-2-enamide
CID 90678958
2-(4-cyanophenyl)-N-cyclohexyl-2-oxoacetamide
CID 24853690
N-cycloheptyl-3-(4-methoxyphenyl)-2-phenylprop-2-enamide
CID 2930228
2-(4-cyclohexylphenyl)-N-cyclopropyl-2-oxoacetamide
CID 94281370
2-(cycloheptylamino)-1-(4-methoxyphenyl)ethanone
CID 2404150
4-N-cyclohexyl-1-N-[2-(4-methoxyphenoxy)ethyl]benzene-1,4-dicarboxamide
CID 109044769
N'-cyclohexyl-N-[4-(4-methoxyphenyl)-3,4-diphenylbut-3-enyl]oxamide
CID 130275872

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-(4-methoxyphenyl)-2-oxoacetamide?
The IUPAC name of N-cyclohexyl-2-(4-methoxyphenyl)-2-oxoacetamide (CID 11414317) is N-cyclohexyl-2-(4-methoxyphenyl)-2-oxoacetamide.
What is the SMILES notation for N-cyclohexyl-2-(4-methoxyphenyl)-2-oxoacetamide?
The canonical SMILES for N-cyclohexyl-2-(4-methoxyphenyl)-2-oxoacetamide is COc1ccc(C(=O)C(=O)NC2CCCCC2)cc1.
What is the InChIKey of N-cyclohexyl-2-(4-methoxyphenyl)-2-oxoacetamide?
The InChIKey is VVVHAIUYUPTNRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO3/c1-19-13-9-7-11(8-10-13)14(17)15(18)16-12-5-3-2-4-6-12/h7-10,12H,2-6H2,1H3,(H,16,18).
What are the key properties of N-cyclohexyl-2-(4-methoxyphenyl)-2-oxoacetamide?
N-cyclohexyl-2-(4-methoxyphenyl)-2-oxoacetamide has a molecular weight of 261.32 g/mol, XLogP of 2.33, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-(4-methoxyphenyl)-2-oxoacetamide is sourced from PubChem (CID 11414317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).