3-(2-aminophenyl)-N-cyclopentyl-N-ethylpropanamide

C16H24N2O — CID 43541570

IUPAC3-(2-aminophenyl)-N-cyclopentyl-N-ethylpropanamide
SMILESCCN(C(=O)CCc1ccccc1N)C1CCCC1
InChIInChI=1S/C16H24N2O/c1-2-18(14-8-4-5-9-14)16(19)12-11-13-7-3-6-10-15(13)17/h3,6-7,10,14H,2,4-5,8-9,11-12,17H2,1H3
InChIKeyHPJBRAITKQSFDM-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.99
Rot. Bonds5

About 3-(2-aminophenyl)-N-cyclopentyl-N-ethylpropanamide

3-(2-aminophenyl)-N-cyclopentyl-N-ethylpropanamide (PubChem CID 43541570) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 3-(2-aminophenyl)-N-cyclopentyl-N-ethylpropanamide.

Molecular Properties

Compound Name3-(2-aminophenyl)-N-cyclopentyl-N-ethylpropanamide
PubChem CID43541570
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name3-(2-aminophenyl)-N-cyclopentyl-N-ethylpropanamide
SMILESCCN(C(=O)CCc1ccccc1N)C1CCCC1
InChIInChI=1S/C16H24N2O/c1-2-18(14-8-4-5-9-14)16(19)12-11-13-7-3-6-10-15(13)17/h3,6-7,10,14H,2,4-5,8-9,11-12,17H2,1H3
InChIKeyHPJBRAITKQSFDM-UHFFFAOYSA-N
XLogP2.99
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-(2-aminophenyl)-N-(1,1-dioxothiolan-3-yl)-N-ethylpropanamide;hydrochloride
CID 120608067
3-(2-aminophenyl)-N-cycloheptyl-N-methylpropanamide;hydrochloride
CID 120608410
N-cyclohexyl-N-ethyl-3-phenylpropanamide
CID 670110
3-(2-aminophenyl)-N-cyclopropyl-N-[(4-ethylphenyl)methyl]propanamide
CID 120608816
2-[2-(2-aminophenyl)ethoxy]-N-cyclopropyl-N-ethylacetamide
CID 102902326
3-(2-chlorophenyl)-N-cyclopropyl-N-ethylpropanamide
CID 51113060
3-(2-aminophenyl)-N-(cyclopropylmethyl)-N-ethylpropanamide
CID 63957099
3-(2-aminophenyl)-N-ethyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)propanamide
CID 120610711
3-(2-aminophenyl)-N-cyclopentyl-N-[2-(3-fluorophenyl)ethyl]propanamide;hydrochloride
CID 120611880
3-(2-aminophenyl)-N-ethyl-N-phenylpropanamide
CID 28713899
3-(2-aminophenyl)-N-(cyclopropylmethyl)-N-methylpropanamide
CID 54883935
3-(2-aminophenyl)-N-methyl-N-(4-methylcyclohexyl)propanamide;hydrochloride
CID 120608242

Frequently Asked Questions

What is the IUPAC name of 3-(2-aminophenyl)-N-cyclopentyl-N-ethylpropanamide?
The IUPAC name of 3-(2-aminophenyl)-N-cyclopentyl-N-ethylpropanamide (CID 43541570) is 3-(2-aminophenyl)-N-cyclopentyl-N-ethylpropanamide.
What is the SMILES notation for 3-(2-aminophenyl)-N-cyclopentyl-N-ethylpropanamide?
The canonical SMILES for 3-(2-aminophenyl)-N-cyclopentyl-N-ethylpropanamide is CCN(C(=O)CCc1ccccc1N)C1CCCC1.
What is the InChIKey of 3-(2-aminophenyl)-N-cyclopentyl-N-ethylpropanamide?
The InChIKey is HPJBRAITKQSFDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-2-18(14-8-4-5-9-14)16(19)12-11-13-7-3-6-10-15(13)17/h3,6-7,10,14H,2,4-5,8-9,11-12,17H2,1H3.
What are the key properties of 3-(2-aminophenyl)-N-cyclopentyl-N-ethylpropanamide?
3-(2-aminophenyl)-N-cyclopentyl-N-ethylpropanamide has a molecular weight of 260.38 g/mol, XLogP of 2.99, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-aminophenyl)-N-cyclopentyl-N-ethylpropanamide is sourced from PubChem (CID 43541570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).