N-(3-cyclohexyloxypropyl)-2-[methyl(1-phenylethyl)amino]acetamide

C20H32N2O2 — CID 60500381

IUPACN-(3-cyclohexyloxypropyl)-2-[methyl(1-phenylethyl)amino]acetamide
SMILESCC(c1ccccc1)N(C)CC(=O)NCCCOC1CCCCC1
InChIInChI=1S/C20H32N2O2/c1-17(18-10-5-3-6-11-18)22(2)16-20(23)21-14-9-15-24-19-12-7-4-8-13-19/h3,5-6,10-11,17,19H,4,7-9,12-16H2,1-2H3,(H,21,23)
InChIKeyVYFWWIQYBMHGHS-UHFFFAOYSA-N
MW332.49 g/mol
LogP3.54
Rot. Bonds9

About N-(3-cyclohexyloxypropyl)-2-[methyl(1-phenylethyl)amino]acetamide

N-(3-cyclohexyloxypropyl)-2-[methyl(1-phenylethyl)amino]acetamide (PubChem CID 60500381) has the molecular formula C20H32N2O2 and a molecular weight of 332.49 g/mol. Its IUPAC name is N-(3-cyclohexyloxypropyl)-2-[methyl(1-phenylethyl)amino]acetamide.

Molecular Properties

Compound NameN-(3-cyclohexyloxypropyl)-2-[methyl(1-phenylethyl)amino]acetamide
PubChem CID60500381
Molecular FormulaC20H32N2O2
Molecular Weight332.49 g/mol
Exact Mass332.25
IUPAC NameN-(3-cyclohexyloxypropyl)-2-[methyl(1-phenylethyl)amino]acetamide
SMILESCC(c1ccccc1)N(C)CC(=O)NCCCOC1CCCCC1
InChIInChI=1S/C20H32N2O2/c1-17(18-10-5-3-6-11-18)22(2)16-20(23)21-14-9-15-24-19-12-7-4-8-13-19/h3,5-6,10-11,17,19H,4,7-9,12-16H2,1-2H3,(H,21,23)
InChIKeyVYFWWIQYBMHGHS-UHFFFAOYSA-N
XLogP3.54
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.49
LogP ≤ 53.54
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

3-cyclohexyloxy-N-(1-phenylethyl)propan-1-amine
CID 43079659
4-[[[2-(3-cyclohexyloxypropylamino)-2-oxoethyl]-methylamino]methyl]-N-methylbenzamide
CID 60503006
2-[[(3-cyclohexyloxypropylamino)-(1-phenylethylamino)methylidene]amino]-N,N-dimethylacetamide;hydroiodide
CID 111545914
2-[N-(benzenesulfonyl)anilino]-N-(3-cyclopentyloxypropyl)acetamide
CID 30174135
2-[cyclohexyl(methyl)amino]-N-(3,3-diphenylpropyl)acetamide
CID 68887856
2-amino-N-(2-cycloheptyloxyethyl)-2-phenylacetamide;hydrochloride
CID 119325370
N-(3-cyclohexyloxypropyl)-2-[[2-(cyclopropylamino)-2-oxoethyl]-methylamino]acetamide
CID 87014178
5-(3-cyclohexyloxypropylamino)-3-methyl-5-oxopentanoic acid
CID 62964201
2-[(4-cyanophenyl)methyl-methylamino]-N-(3-cyclohexyloxypropyl)acetamide
CID 87016434
N-(3-cyclohexyloxypropyl)-2-[methylsulfonyl(naphthalen-1-yl)amino]acetamide
CID 30224429
N-(3-cyclohexyloxypropyl)-4-propan-2-ylbenzamide
CID 134029978
1-(3-cyclopentyloxypropyl)-2-methyl-3-(1-phenylethyl)guanidine
CID 110948758

Frequently Asked Questions

What is the IUPAC name of N-(3-cyclohexyloxypropyl)-2-[methyl(1-phenylethyl)amino]acetamide?
The IUPAC name of N-(3-cyclohexyloxypropyl)-2-[methyl(1-phenylethyl)amino]acetamide (CID 60500381) is N-(3-cyclohexyloxypropyl)-2-[methyl(1-phenylethyl)amino]acetamide.
What is the SMILES notation for N-(3-cyclohexyloxypropyl)-2-[methyl(1-phenylethyl)amino]acetamide?
The canonical SMILES for N-(3-cyclohexyloxypropyl)-2-[methyl(1-phenylethyl)amino]acetamide is CC(c1ccccc1)N(C)CC(=O)NCCCOC1CCCCC1.
What is the InChIKey of N-(3-cyclohexyloxypropyl)-2-[methyl(1-phenylethyl)amino]acetamide?
The InChIKey is VYFWWIQYBMHGHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H32N2O2/c1-17(18-10-5-3-6-11-18)22(2)16-20(23)21-14-9-15-24-19-12-7-4-8-13-19/h3,5-6,10-11,17,19H,4,7-9,12-16H2,1-2H3,(H,21,23).
What are the key properties of N-(3-cyclohexyloxypropyl)-2-[methyl(1-phenylethyl)amino]acetamide?
N-(3-cyclohexyloxypropyl)-2-[methyl(1-phenylethyl)amino]acetamide has a molecular weight of 332.49 g/mol, XLogP of 3.54, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyclohexyloxypropyl)-2-[methyl(1-phenylethyl)amino]acetamide is sourced from PubChem (CID 60500381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).