2-[(4-amino-3-ethoxybutyl)-cyclohexylamino]ethanol

C14H30N2O2 — CID 63070100

IUPAC2-[(4-amino-3-ethoxybutyl)-cyclohexylamino]ethanol
SMILESCCOC(CN)CCN(CCO)C1CCCCC1
InChIInChI=1S/C14H30N2O2/c1-2-18-14(12-15)8-9-16(10-11-17)13-6-4-3-5-7-13/h13-14,17H,2-12,15H2,1H3
InChIKeyHIABLZXRINDBOC-UHFFFAOYSA-N
MW258.41 g/mol
LogP1.37
Rot. Bonds9

About 2-[(4-amino-3-ethoxybutyl)-cyclohexylamino]ethanol

2-[(4-amino-3-ethoxybutyl)-cyclohexylamino]ethanol (PubChem CID 63070100) has the molecular formula C14H30N2O2 and a molecular weight of 258.41 g/mol. Its IUPAC name is 2-[(4-amino-3-ethoxybutyl)-cyclohexylamino]ethanol.

Molecular Properties

Compound Name2-[(4-amino-3-ethoxybutyl)-cyclohexylamino]ethanol
PubChem CID63070100
Molecular FormulaC14H30N2O2
Molecular Weight258.41 g/mol
Exact Mass258.23
IUPAC Name2-[(4-amino-3-ethoxybutyl)-cyclohexylamino]ethanol
SMILESCCOC(CN)CCN(CCO)C1CCCCC1
InChIInChI=1S/C14H30N2O2/c1-2-18-14(12-15)8-9-16(10-11-17)13-6-4-3-5-7-13/h13-14,17H,2-12,15H2,1H3
InChIKeyHIABLZXRINDBOC-UHFFFAOYSA-N
XLogP1.37
TPSA58.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[(4-amino-3-ethoxybutyl)-cyclohexylamino]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

N'-cyclopropyl-2-ethoxy-N'-methylbutane-1,4-diamine
CID 63069693
2-[cyclohexyl(2-hydroxyethyl)amino]ethanol;nickel
CID 88833532
1-[cyclopentyl(2-hydroxyethyl)amino]-4,4-dimethylpentan-3-ol
CID 62624115
2-[cyclohexyl(2-ethylbutyl)amino]ethanol
CID 82930046
(2R)-2-ethoxy-N',N'-dimethylbutane-1,4-diamine
CID 95006031
2-[cyclopentyl(2-methylpentyl)amino]ethanol
CID 62266267
N'-butyl-N'-cyclopropyl-2-methoxybutane-1,4-diamine
CID 103152316
3-(aminomethyl)-N-cyclohexyl-N-(2-hydroxyethyl)pentanamide
CID 81086894
2-[cyclopentyl(octyl)amino]ethanol
CID 62015443
2-[(6-amino-5,5-dimethylhexyl)-cyclohexylamino]ethanol
CID 106708020
2-[cyclopentyl(2-hydroxyethyl)amino]-N,N-dipropylacetamide
CID 62015247
2-[cyclohexyl-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]amino]ethanol
CID 104566071

Frequently Asked Questions

What is the IUPAC name of 2-[(4-amino-3-ethoxybutyl)-cyclohexylamino]ethanol?
The IUPAC name of 2-[(4-amino-3-ethoxybutyl)-cyclohexylamino]ethanol (CID 63070100) is 2-[(4-amino-3-ethoxybutyl)-cyclohexylamino]ethanol.
What is the SMILES notation for 2-[(4-amino-3-ethoxybutyl)-cyclohexylamino]ethanol?
The canonical SMILES for 2-[(4-amino-3-ethoxybutyl)-cyclohexylamino]ethanol is CCOC(CN)CCN(CCO)C1CCCCC1.
What is the InChIKey of 2-[(4-amino-3-ethoxybutyl)-cyclohexylamino]ethanol?
The InChIKey is HIABLZXRINDBOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O2/c1-2-18-14(12-15)8-9-16(10-11-17)13-6-4-3-5-7-13/h13-14,17H,2-12,15H2,1H3.
What are the key properties of 2-[(4-amino-3-ethoxybutyl)-cyclohexylamino]ethanol?
2-[(4-amino-3-ethoxybutyl)-cyclohexylamino]ethanol has a molecular weight of 258.41 g/mol, XLogP of 1.37, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-amino-3-ethoxybutyl)-cyclohexylamino]ethanol is sourced from PubChem (CID 63070100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).