2-(4-aminophenyl)-N-cyclohexyl-N-(cyclopropylmethyl)acetamide

C18H26N2O — CID 119769987

IUPAC2-(4-aminophenyl)-N-cyclohexyl-N-(cyclopropylmethyl)acetamide
SMILESNc1ccc(CC(=O)N(CC2CC2)C2CCCCC2)cc1
InChIInChI=1S/C18H26N2O/c19-16-10-8-14(9-11-16)12-18(21)20(13-15-6-7-15)17-4-2-1-3-5-17/h8-11,15,17H,1-7,12-13,19H2
InChIKeyAJIYCXZNIKBYDS-UHFFFAOYSA-N
MW286.42 g/mol
LogP3.38
Rot. Bonds5

About 2-(4-aminophenyl)-N-cyclohexyl-N-(cyclopropylmethyl)acetamide

2-(4-aminophenyl)-N-cyclohexyl-N-(cyclopropylmethyl)acetamide (PubChem CID 119769987) has the molecular formula C18H26N2O and a molecular weight of 286.42 g/mol. Its IUPAC name is 2-(4-aminophenyl)-N-cyclohexyl-N-(cyclopropylmethyl)acetamide.

Molecular Properties

Compound Name2-(4-aminophenyl)-N-cyclohexyl-N-(cyclopropylmethyl)acetamide
PubChem CID119769987
Molecular FormulaC18H26N2O
Molecular Weight286.42 g/mol
Exact Mass286.20
IUPAC Name2-(4-aminophenyl)-N-cyclohexyl-N-(cyclopropylmethyl)acetamide
SMILESNc1ccc(CC(=O)N(CC2CC2)C2CCCCC2)cc1
InChIInChI=1S/C18H26N2O/c19-16-10-8-14(9-11-16)12-18(21)20(13-15-6-7-15)17-4-2-1-3-5-17/h8-11,15,17H,1-7,12-13,19H2
InChIKeyAJIYCXZNIKBYDS-UHFFFAOYSA-N
XLogP3.38
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_no_alk(40)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-(4-aminophenyl)-N-cyclobutyl-N-methylacetamide
CID 115739567
2-(4-aminophenyl)-N-cyclopropyl-N-methylacetamide
CID 43264480
2-(4-aminophenyl)-N-(4-methylcyclohexyl)-N-(oxolan-2-ylmethyl)acetamide;hydrochloride
CID 119805627
2-(4-aminophenyl)-1-cyclohexylethanone
CID 116549419
2-[4-(aminomethyl)phenyl]-N-(2-amino-2-oxoethyl)-N-cyclopentylacetamide
CID 63589438
N-[(4-aminophenyl)methyl]-2-cyclobutyl-N-cyclopropylacetamide
CID 103161534
N-(2-chloroethyl)-2-(4-chlorophenyl)-N-cyclohexylacetamide
CID 63391287
N-cyclopropyl-2-(4-fluorophenyl)-N-(piperidin-2-ylmethyl)acetamide
CID 106626819
1-(4-aminophenyl)-3-cyclopentylpropan-2-one
CID 116549551
cyclohexylmethyl 2-(4-aminophenyl)acetate
CID 61321508
N-(2-amino-2-oxoethyl)-N-cyclopentyl-2-(4-sulfanylphenyl)acetamide
CID 107026216
2-[4-(aminomethyl)phenyl]-N-cyclobutyl-N-(2-hydroxyethyl)acetamide
CID 102858984

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminophenyl)-N-cyclohexyl-N-(cyclopropylmethyl)acetamide?
The IUPAC name of 2-(4-aminophenyl)-N-cyclohexyl-N-(cyclopropylmethyl)acetamide (CID 119769987) is 2-(4-aminophenyl)-N-cyclohexyl-N-(cyclopropylmethyl)acetamide.
What is the SMILES notation for 2-(4-aminophenyl)-N-cyclohexyl-N-(cyclopropylmethyl)acetamide?
The canonical SMILES for 2-(4-aminophenyl)-N-cyclohexyl-N-(cyclopropylmethyl)acetamide is Nc1ccc(CC(=O)N(CC2CC2)C2CCCCC2)cc1.
What is the InChIKey of 2-(4-aminophenyl)-N-cyclohexyl-N-(cyclopropylmethyl)acetamide?
The InChIKey is AJIYCXZNIKBYDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O/c19-16-10-8-14(9-11-16)12-18(21)20(13-15-6-7-15)17-4-2-1-3-5-17/h8-11,15,17H,1-7,12-13,19H2.
What are the key properties of 2-(4-aminophenyl)-N-cyclohexyl-N-(cyclopropylmethyl)acetamide?
2-(4-aminophenyl)-N-cyclohexyl-N-(cyclopropylmethyl)acetamide has a molecular weight of 286.42 g/mol, XLogP of 3.38, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminophenyl)-N-cyclohexyl-N-(cyclopropylmethyl)acetamide is sourced from PubChem (CID 119769987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).