2-[2-(1-aminopropyl)-N-cyclohexylanilino]ethanol

C17H28N2O — CID 115995044

IUPAC2-[2-(1-aminopropyl)-N-cyclohexylanilino]ethanol
SMILESCCC(N)c1ccccc1N(CCO)C1CCCCC1
InChIInChI=1S/C17H28N2O/c1-2-16(18)15-10-6-7-11-17(15)19(12-13-20)14-8-4-3-5-9-14/h6-7,10-11,14,16,20H,2-5,8-9,12-13,18H2,1H3
InChIKeyRYOKHHKZSFQSQY-UHFFFAOYSA-N
MW276.42 g/mol
LogP3.23
Rot. Bonds6

About 2-[2-(1-aminopropyl)-N-cyclohexylanilino]ethanol

2-[2-(1-aminopropyl)-N-cyclohexylanilino]ethanol (PubChem CID 115995044) has the molecular formula C17H28N2O and a molecular weight of 276.42 g/mol. Its IUPAC name is 2-[2-(1-aminopropyl)-N-cyclohexylanilino]ethanol.

Molecular Properties

Compound Name2-[2-(1-aminopropyl)-N-cyclohexylanilino]ethanol
PubChem CID115995044
Molecular FormulaC17H28N2O
Molecular Weight276.42 g/mol
Exact Mass276.22
IUPAC Name2-[2-(1-aminopropyl)-N-cyclohexylanilino]ethanol
SMILESCCC(N)c1ccccc1N(CCO)C1CCCCC1
InChIInChI=1S/C17H28N2O/c1-2-16(18)15-10-6-7-11-17(15)19(12-13-20)14-8-4-3-5-9-14/h6-7,10-11,14,16,20H,2-5,8-9,12-13,18H2,1H3
InChIKeyRYOKHHKZSFQSQY-UHFFFAOYSA-N
XLogP3.23
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.42
LogP ≤ 53.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[2-(1-aminopropyl)-N-cyclohexylanilino]ethanol 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-[(1R)-1-aminoethyl]-N-cyclobutylanilino]ethanol
CID 102863448
2-[(1R)-1-aminopropyl]-N-cyclopentyl-N-ethylaniline
CID 103958535
2-[2-[(1R)-1-aminoethyl]-N-cyclopropylanilino]ethanol
CID 78935565
2-[2-[(1S)-1-aminoethyl]-N-cyclopropylanilino]ethanol
CID 63368640
2-(1-aminopropyl)-N-cyclopropyl-N-(3-methylbutyl)aniline
CID 112678059
2-[N-cyclohexyl-2-(hydroxymethyl)anilino]ethanol
CID 54994680
1-[2-[cyclobutyl(3-hydroxypropyl)amino]phenyl]propan-1-ol
CID 102864135
2-[N-cyclopropyl-2-[1-(methylamino)propyl]anilino]ethanol
CID 112678034
2-[2-(1-aminopropyl)-N-ethylanilino]ethanol
CID 112677936
2-[(1S)-1-aminopropyl]-N-(cyclohexylmethyl)-N-methylaniline
CID 103958669
2-(1-aminoethyl)-N-cyclopropyl-N-(3-methylbutyl)aniline
CID 78974160

Frequently Asked Questions

What is the IUPAC name of 2-[2-(1-aminopropyl)-N-cyclohexylanilino]ethanol?
The IUPAC name of 2-[2-(1-aminopropyl)-N-cyclohexylanilino]ethanol (CID 115995044) is 2-[2-(1-aminopropyl)-N-cyclohexylanilino]ethanol.
What is the SMILES notation for 2-[2-(1-aminopropyl)-N-cyclohexylanilino]ethanol?
The canonical SMILES for 2-[2-(1-aminopropyl)-N-cyclohexylanilino]ethanol is CCC(N)c1ccccc1N(CCO)C1CCCCC1.
What is the InChIKey of 2-[2-(1-aminopropyl)-N-cyclohexylanilino]ethanol?
The InChIKey is RYOKHHKZSFQSQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O/c1-2-16(18)15-10-6-7-11-17(15)19(12-13-20)14-8-4-3-5-9-14/h6-7,10-11,14,16,20H,2-5,8-9,12-13,18H2,1H3.
What are the key properties of 2-[2-(1-aminopropyl)-N-cyclohexylanilino]ethanol?
2-[2-(1-aminopropyl)-N-cyclohexylanilino]ethanol has a molecular weight of 276.42 g/mol, XLogP of 3.23, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(1-aminopropyl)-N-cyclohexylanilino]ethanol is sourced from PubChem (CID 115995044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).