N-[1-(aminomethyl)cyclohexyl]-2-phenoxyacetamide

C15H22N2O2 — CID 63755837

IUPACN-[1-(aminomethyl)cyclohexyl]-2-phenoxyacetamide
SMILESNCC1(NC(=O)COc2ccccc2)CCCCC1
InChIInChI=1S/C15H22N2O2/c16-12-15(9-5-2-6-10-15)17-14(18)11-19-13-7-3-1-4-8-13/h1,3-4,7-8H,2,5-6,9-12,16H2,(H,17,18)
InChIKeyGMSPHLCLCBQSDY-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.84
Rot. Bonds5

About N-[1-(aminomethyl)cyclohexyl]-2-phenoxyacetamide

N-[1-(aminomethyl)cyclohexyl]-2-phenoxyacetamide (PubChem CID 63755837) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-[1-(aminomethyl)cyclohexyl]-2-phenoxyacetamide.

Molecular Properties

Compound NameN-[1-(aminomethyl)cyclohexyl]-2-phenoxyacetamide
PubChem CID63755837
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-[1-(aminomethyl)cyclohexyl]-2-phenoxyacetamide
SMILESNCC1(NC(=O)COc2ccccc2)CCCCC1
InChIInChI=1S/C15H22N2O2/c16-12-15(9-5-2-6-10-15)17-14(18)11-19-13-7-3-1-4-8-13/h1,3-4,7-8H,2,5-6,9-12,16H2,(H,17,18)
InChIKeyGMSPHLCLCBQSDY-UHFFFAOYSA-N
XLogP1.84
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(aminomethyl)cyclopentyl]-2-(4-iodophenoxy)acetamide;hydrochloride
CID 119567396
2-[1-[(2-phenoxyacetyl)amino]cyclopentyl]acetic acid
CID 64673162
N-[1-(aminomethyl)cyclopentyl]-2-(3-methylphenoxy)acetamide;hydrochloride
CID 119567192
N-[1-(aminomethyl)cyclopentyl]-2-(3,4-dimethylphenoxy)acetamide
CID 119565775
N-(1-carbamothioylcyclopentyl)-2-phenoxyacetamide
CID 61118930
N-[1-(aminomethyl)cyclopentyl]-2-[2-(2,2,2-trifluoroethoxy)phenoxy]acetamide;hydrochloride
CID 119565633
N-[1-(aminomethyl)cyclohexyl]-2-methoxyacetamide
CID 63755662
N-[1-(aminomethyl)cyclopentyl]-2-(4-phenylphenyl)acetamide
CID 119564798
N-[1-(aminomethyl)cyclopentyl]-4-phenylbutanamide
CID 63754522
N-[1-(aminomethyl)cyclopentyl]-4-oxo-4-phenylbutanamide;hydrochloride
CID 119568158
1-[[2-[(2-phenoxyacetyl)amino]acetyl]amino]cycloheptane-1-carboxylic acid
CID 120538943
N-[1-(aminomethyl)cyclopentyl]-2-(2-butan-2-ylphenoxy)acetamide;hydrochloride
CID 119567384

Frequently Asked Questions

What is the IUPAC name of N-[1-(aminomethyl)cyclohexyl]-2-phenoxyacetamide?
The IUPAC name of N-[1-(aminomethyl)cyclohexyl]-2-phenoxyacetamide (CID 63755837) is N-[1-(aminomethyl)cyclohexyl]-2-phenoxyacetamide.
What is the SMILES notation for N-[1-(aminomethyl)cyclohexyl]-2-phenoxyacetamide?
The canonical SMILES for N-[1-(aminomethyl)cyclohexyl]-2-phenoxyacetamide is NCC1(NC(=O)COc2ccccc2)CCCCC1.
What is the InChIKey of N-[1-(aminomethyl)cyclohexyl]-2-phenoxyacetamide?
The InChIKey is GMSPHLCLCBQSDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c16-12-15(9-5-2-6-10-15)17-14(18)11-19-13-7-3-1-4-8-13/h1,3-4,7-8H,2,5-6,9-12,16H2,(H,17,18).
What are the key properties of N-[1-(aminomethyl)cyclohexyl]-2-phenoxyacetamide?
N-[1-(aminomethyl)cyclohexyl]-2-phenoxyacetamide has a molecular weight of 262.35 g/mol, XLogP of 1.84, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(aminomethyl)cyclohexyl]-2-phenoxyacetamide is sourced from PubChem (CID 63755837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).