1-(4-aminophenyl)-2-(cyclohexylamino)ethanone

C14H20N2O — CID 82258202

IUPAC1-(4-aminophenyl)-2-(cyclohexylamino)ethanone
SMILESNc1ccc(C(=O)CNC2CCCCC2)cc1
InChIInChI=1S/C14H20N2O/c15-12-8-6-11(7-9-12)14(17)10-16-13-4-2-1-3-5-13/h6-9,13,16H,1-5,10,15H2
InChIKeyIZGMUSJLBSHULT-UHFFFAOYSA-N
MW232.33 g/mol
LogP2.37
Rot. Bonds4

About 1-(4-aminophenyl)-2-(cyclohexylamino)ethanone

1-(4-aminophenyl)-2-(cyclohexylamino)ethanone (PubChem CID 82258202) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 1-(4-aminophenyl)-2-(cyclohexylamino)ethanone.

Molecular Properties

Compound Name1-(4-aminophenyl)-2-(cyclohexylamino)ethanone
PubChem CID82258202
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name1-(4-aminophenyl)-2-(cyclohexylamino)ethanone
SMILESNc1ccc(C(=O)CNC2CCCCC2)cc1
InChIInChI=1S/C14H20N2O/c15-12-8-6-11(7-9-12)14(17)10-16-13-4-2-1-3-5-13/h6-9,13,16H,1-5,10,15H2
InChIKeyIZGMUSJLBSHULT-UHFFFAOYSA-N
XLogP2.37
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 1-(4-aminophenyl)-2-(cyclohexylamino)ethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(4-aminophenyl)-2-(cyclopentylamino)ethanone
CID 82258201
1-(4-tert-butylphenyl)-2-(cycloheptylamino)ethanone
CID 82101744
1-(4-tert-butylphenyl)-2-(cyclohexylamino)ethanone
CID 82101742
2-(cyclooctylamino)-1-(4-ethylphenyl)ethanone
CID 82101307
2-(cycloheptylamino)-1-(4-methoxyphenyl)ethanone
CID 2404150
2-(cyclopentylamino)-1-(4-cyclopropyloxyphenyl)ethanone
CID 114520577
2-(cyclooctylamino)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanone
CID 82101392
2-(cyclohexylamino)-1-(2,3-dihydro-1H-indol-5-yl)ethanone
CID 82257913
4-amino-N-cyclohexylbenzamide;hydrochloride
CID 83814043
2-(cyclopentylamino)-1-(3,4-dimethoxyphenyl)ethanone
CID 82102039
3-(cyclohexylamino)propyl 4-aminobenzoate;hydrochloride
CID 24843482
2-amino-5-[2-(cyclobutylamino)acetyl]benzonitrile;hydrochloride
CID 22765844

Frequently Asked Questions

What is the IUPAC name of 1-(4-aminophenyl)-2-(cyclohexylamino)ethanone?
The IUPAC name of 1-(4-aminophenyl)-2-(cyclohexylamino)ethanone (CID 82258202) is 1-(4-aminophenyl)-2-(cyclohexylamino)ethanone.
What is the SMILES notation for 1-(4-aminophenyl)-2-(cyclohexylamino)ethanone?
The canonical SMILES for 1-(4-aminophenyl)-2-(cyclohexylamino)ethanone is Nc1ccc(C(=O)CNC2CCCCC2)cc1.
What is the InChIKey of 1-(4-aminophenyl)-2-(cyclohexylamino)ethanone?
The InChIKey is IZGMUSJLBSHULT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c15-12-8-6-11(7-9-12)14(17)10-16-13-4-2-1-3-5-13/h6-9,13,16H,1-5,10,15H2.
What are the key properties of 1-(4-aminophenyl)-2-(cyclohexylamino)ethanone?
1-(4-aminophenyl)-2-(cyclohexylamino)ethanone has a molecular weight of 232.33 g/mol, XLogP of 2.37, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-aminophenyl)-2-(cyclohexylamino)ethanone is sourced from PubChem (CID 82258202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).