N-(3-cyclohexyloxypropyl)-2-(4-methylphenoxy)acetamide

C18H27NO3 — CID 134030025

IUPACN-(3-cyclohexyloxypropyl)-2-(4-methylphenoxy)acetamide
SMILESCc1ccc(OCC(=O)NCCCOC2CCCCC2)cc1
InChIInChI=1S/C18H27NO3/c1-15-8-10-17(11-9-15)22-14-18(20)19-12-5-13-21-16-6-3-2-4-7-16/h8-11,16H,2-7,12-14H2,1H3,(H,19,20)
InChIKeyULVIREPIJQXLCZ-UHFFFAOYSA-N
MW305.42 g/mol
LogP3.23
Rot. Bonds8

About N-(3-cyclohexyloxypropyl)-2-(4-methylphenoxy)acetamide

N-(3-cyclohexyloxypropyl)-2-(4-methylphenoxy)acetamide (PubChem CID 134030025) has the molecular formula C18H27NO3 and a molecular weight of 305.42 g/mol. Its IUPAC name is N-(3-cyclohexyloxypropyl)-2-(4-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-(3-cyclohexyloxypropyl)-2-(4-methylphenoxy)acetamide
PubChem CID134030025
Molecular FormulaC18H27NO3
Molecular Weight305.42 g/mol
Exact Mass305.20
IUPAC NameN-(3-cyclohexyloxypropyl)-2-(4-methylphenoxy)acetamide
SMILESCc1ccc(OCC(=O)NCCCOC2CCCCC2)cc1
InChIInChI=1S/C18H27NO3/c1-15-8-10-17(11-9-15)22-14-18(20)19-12-5-13-21-16-6-3-2-4-7-16/h8-11,16H,2-7,12-14H2,1H3,(H,19,20)
InChIKeyULVIREPIJQXLCZ-UHFFFAOYSA-N
XLogP3.23
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.42
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(3-cyclohexyloxypropyl)-2-(3-methylphenoxy)acetamide
CID 134029943
N-(3-cyclohexyloxypropyl)-2-[(2-phenoxyacetyl)amino]acetamide
CID 40659124
2-(4-cyclohexylphenoxy)-N-[2-(4-methylphenoxy)ethyl]acetamide
CID 621407
2-amino-N-(3-cyclohexyloxypropyl)-2-(4-methylphenyl)acetamide
CID 120666811
N-(3-cyclohexyloxypropyl)-2-ethoxyacetamide
CID 60668714
N-cyclododecyl-2-(4-methylphenoxy)acetamide
CID 2788426
N-(3-acetamidopropyl)-2-(4-methylphenoxy)acetamide
CID 110292109
N-(3-methoxypropyl)-2-[[2-(4-methylphenoxy)acetyl]amino]acetamide
CID 112991225
N-(3-cyclohexyloxypropyl)-2-[(3-oxo-4H-1,4-benzoxazin-7-yl)oxy]acetamide
CID 166266578
N-[3-[2-(3-cyclohexyloxypropylamino)-2-oxoethoxy]phenyl]benzamide
CID 78902869
N-(3-aminopropyl)-2-(4-methylphenoxy)acetamide;hydrochloride
CID 119405354
N-(3-cyclohexyloxypropyl)-2-(2-nitrophenoxy)acetamide
CID 51222276

Frequently Asked Questions

What is the IUPAC name of N-(3-cyclohexyloxypropyl)-2-(4-methylphenoxy)acetamide?
The IUPAC name of N-(3-cyclohexyloxypropyl)-2-(4-methylphenoxy)acetamide (CID 134030025) is N-(3-cyclohexyloxypropyl)-2-(4-methylphenoxy)acetamide.
What is the SMILES notation for N-(3-cyclohexyloxypropyl)-2-(4-methylphenoxy)acetamide?
The canonical SMILES for N-(3-cyclohexyloxypropyl)-2-(4-methylphenoxy)acetamide is Cc1ccc(OCC(=O)NCCCOC2CCCCC2)cc1.
What is the InChIKey of N-(3-cyclohexyloxypropyl)-2-(4-methylphenoxy)acetamide?
The InChIKey is ULVIREPIJQXLCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27NO3/c1-15-8-10-17(11-9-15)22-14-18(20)19-12-5-13-21-16-6-3-2-4-7-16/h8-11,16H,2-7,12-14H2,1H3,(H,19,20).
What are the key properties of N-(3-cyclohexyloxypropyl)-2-(4-methylphenoxy)acetamide?
N-(3-cyclohexyloxypropyl)-2-(4-methylphenoxy)acetamide has a molecular weight of 305.42 g/mol, XLogP of 3.23, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyclohexyloxypropyl)-2-(4-methylphenoxy)acetamide is sourced from PubChem (CID 134030025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).