2-[(1R)-1-aminopropyl]-N-cyclopentyl-N-ethylaniline

C16H26N2 — CID 103958535

IUPAC2-[(1R)-1-aminopropyl]-N-cyclopentyl-N-ethylaniline
SMILESCC[C@@H](N)c1ccccc1N(CC)C1CCCC1
InChIInChI=1S/C16H26N2/c1-3-15(17)14-11-7-8-12-16(14)18(4-2)13-9-5-6-10-13/h7-8,11-13,15H,3-6,9-10,17H2,1-2H3/t15-/m1/s1
InChIKeyDERLXSJHRWAFJR-OAHLLOKOSA-N
MW246.40 g/mol
LogP3.87
Rot. Bonds5

About 2-[(1R)-1-aminopropyl]-N-cyclopentyl-N-ethylaniline

2-[(1R)-1-aminopropyl]-N-cyclopentyl-N-ethylaniline (PubChem CID 103958535) has the molecular formula C16H26N2 and a molecular weight of 246.40 g/mol. Its IUPAC name is 2-[(1R)-1-aminopropyl]-N-cyclopentyl-N-ethylaniline.

Molecular Properties

Compound Name2-[(1R)-1-aminopropyl]-N-cyclopentyl-N-ethylaniline
PubChem CID103958535
Molecular FormulaC16H26N2
Molecular Weight246.40 g/mol
Exact Mass246.21
IUPAC Name2-[(1R)-1-aminopropyl]-N-cyclopentyl-N-ethylaniline
SMILESCC[C@@H](N)c1ccccc1N(CC)C1CCCC1
InChIInChI=1S/C16H26N2/c1-3-15(17)14-11-7-8-12-16(14)18(4-2)13-9-5-6-10-13/h7-8,11-13,15H,3-6,9-10,17H2,1-2H3/t15-/m1/s1
InChIKeyDERLXSJHRWAFJR-OAHLLOKOSA-N
XLogP3.87
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.40
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-[(1R)-1-aminopropyl]-N-cyclopentyl-N-ethylaniline 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

2-[2-[(1R)-1-aminopropyl]-N-cyclopentylanilino]ethanol
CID 103958723
2-[2-(1-aminopropyl)-N-cyclohexylanilino]ethanol
CID 115995044
2-(1-aminopropyl)-N-cyclopropyl-N-(3-methylbutyl)aniline
CID 112678059
(1S)-1-[2-[cyclopropyl(ethyl)amino]phenyl]propan-1-ol
CID 103959730
2-(1-aminopropyl)-N-ethyl-N-methylaniline
CID 23460228
2-[(1R)-1-aminopropyl]-N-methyl-N-(3-methylcyclohexyl)aniline
CID 103958672
2-[(1S)-1-aminopropyl]-N-(cyclohexylmethyl)-N-methylaniline
CID 103958669
N-[2-[(1R)-1-aminopropyl]phenyl]-N-methyloxan-4-amine
CID 113358796
N-[2-[(1S)-1-aminopropyl]phenyl]-1-ethyl-N-methylpiperidin-4-amine
CID 103958750
2-(1-aminopropyl)-N,N-dimethylaniline
CID 112704132
2-[2-[(1R)-1-aminoethyl]-N-cyclobutylanilino]ethanol
CID 102863448
N-cyclopropyl-N-ethyl-2-[1-(propylamino)propyl]aniline
CID 112677823

Frequently Asked Questions

What is the IUPAC name of 2-[(1R)-1-aminopropyl]-N-cyclopentyl-N-ethylaniline?
The IUPAC name of 2-[(1R)-1-aminopropyl]-N-cyclopentyl-N-ethylaniline (CID 103958535) is 2-[(1R)-1-aminopropyl]-N-cyclopentyl-N-ethylaniline.
What is the SMILES notation for 2-[(1R)-1-aminopropyl]-N-cyclopentyl-N-ethylaniline?
The canonical SMILES for 2-[(1R)-1-aminopropyl]-N-cyclopentyl-N-ethylaniline is CC[C@@H](N)c1ccccc1N(CC)C1CCCC1.
What is the InChIKey of 2-[(1R)-1-aminopropyl]-N-cyclopentyl-N-ethylaniline?
The InChIKey is DERLXSJHRWAFJR-OAHLLOKOSA-N. The full InChI is InChI=1S/C16H26N2/c1-3-15(17)14-11-7-8-12-16(14)18(4-2)13-9-5-6-10-13/h7-8,11-13,15H,3-6,9-10,17H2,1-2H3/t15-/m1/s1.
What are the key properties of 2-[(1R)-1-aminopropyl]-N-cyclopentyl-N-ethylaniline?
2-[(1R)-1-aminopropyl]-N-cyclopentyl-N-ethylaniline has a molecular weight of 246.40 g/mol, XLogP of 3.87, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1R)-1-aminopropyl]-N-cyclopentyl-N-ethylaniline is sourced from PubChem (CID 103958535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).