2-(3-aminophenyl)-N-(2-ethylcyclohexyl)acetamide

C16H24N2O — CID 55083950

IUPAC2-(3-aminophenyl)-N-(2-ethylcyclohexyl)acetamide
SMILESCCC1CCCCC1NC(=O)Cc1cccc(N)c1
InChIInChI=1S/C16H24N2O/c1-2-13-7-3-4-9-15(13)18-16(19)11-12-6-5-8-14(17)10-12/h5-6,8,10,13,15H,2-4,7,9,11,17H2,1H3,(H,18,19)
InChIKeyPOGNQELMWUFMGQ-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.90
Rot. Bonds4

About 2-(3-aminophenyl)-N-(2-ethylcyclohexyl)acetamide

2-(3-aminophenyl)-N-(2-ethylcyclohexyl)acetamide (PubChem CID 55083950) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 2-(3-aminophenyl)-N-(2-ethylcyclohexyl)acetamide.

Molecular Properties

Compound Name2-(3-aminophenyl)-N-(2-ethylcyclohexyl)acetamide
PubChem CID55083950
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name2-(3-aminophenyl)-N-(2-ethylcyclohexyl)acetamide
SMILESCCC1CCCCC1NC(=O)Cc1cccc(N)c1
InChIInChI=1S/C16H24N2O/c1-2-13-7-3-4-9-15(13)18-16(19)11-12-6-5-8-14(17)10-12/h5-6,8,10,13,15H,2-4,7,9,11,17H2,1H3,(H,18,19)
InChIKeyPOGNQELMWUFMGQ-UHFFFAOYSA-N
XLogP2.90
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(3-aminophenyl)-N-cyclohexylacetamide
CID 28689689
2-(3-aminophenyl)-N-cycloheptylacetamide
CID 28712073
2-(4-carbamothioylphenyl)-N-(2-ethylcyclohexyl)acetamide
CID 63591247
3-(3-aminophenyl)-N-[(1S,2S)-2-hydroxycyclohexyl]propanamide
CID 107211275
3-(2-aminophenyl)-N-(2-ethylcyclohexyl)propanamide;hydrochloride
CID 120609307
N-[2-(bromomethyl)cyclopentyl]-2-(3-bromophenyl)acetamide
CID 106366253
2-(3-aminophenyl)-N-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl)acetamide
CID 55084044
1-[3-(aminomethyl)phenyl]-3-(2-ethylcyclohexyl)urea
CID 61468180
N-[2-(hydroxymethyl)cyclohexyl]-2-(3-methoxyphenyl)acetamide
CID 103798501
2-(3-aminophenyl)-N-[(1R,3R)-3-methylcyclohexyl]acetamide
CID 28689697
N-[2-(bromomethyl)cyclopentyl]-2-(3-methylphenyl)acetamide
CID 106366301
N-[2-(aminomethyl)cyclohexyl]-2-(4-aminophenyl)acetamide
CID 122080741

Frequently Asked Questions

What is the IUPAC name of 2-(3-aminophenyl)-N-(2-ethylcyclohexyl)acetamide?
The IUPAC name of 2-(3-aminophenyl)-N-(2-ethylcyclohexyl)acetamide (CID 55083950) is 2-(3-aminophenyl)-N-(2-ethylcyclohexyl)acetamide.
What is the SMILES notation for 2-(3-aminophenyl)-N-(2-ethylcyclohexyl)acetamide?
The canonical SMILES for 2-(3-aminophenyl)-N-(2-ethylcyclohexyl)acetamide is CCC1CCCCC1NC(=O)Cc1cccc(N)c1.
What is the InChIKey of 2-(3-aminophenyl)-N-(2-ethylcyclohexyl)acetamide?
The InChIKey is POGNQELMWUFMGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-2-13-7-3-4-9-15(13)18-16(19)11-12-6-5-8-14(17)10-12/h5-6,8,10,13,15H,2-4,7,9,11,17H2,1H3,(H,18,19).
What are the key properties of 2-(3-aminophenyl)-N-(2-ethylcyclohexyl)acetamide?
2-(3-aminophenyl)-N-(2-ethylcyclohexyl)acetamide has a molecular weight of 260.38 g/mol, XLogP of 2.90, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-aminophenyl)-N-(2-ethylcyclohexyl)acetamide is sourced from PubChem (CID 55083950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).