2-[butyl-(2-ethylcyclohexyl)amino]ethanol

C14H29NO — CID 63861495

IUPAC2-[butyl-(2-ethylcyclohexyl)amino]ethanol
SMILESCCCCN(CCO)C1CCCCC1CC
InChIInChI=1S/C14H29NO/c1-3-5-10-15(11-12-16)14-9-7-6-8-13(14)4-2/h13-14,16H,3-12H2,1-2H3
InChIKeyHWHSAGCDAYMZFC-UHFFFAOYSA-N
MW227.39 g/mol
LogP3.05
Rot. Bonds7

About 2-[butyl-(2-ethylcyclohexyl)amino]ethanol

2-[butyl-(2-ethylcyclohexyl)amino]ethanol (PubChem CID 63861495) has the molecular formula C14H29NO and a molecular weight of 227.39 g/mol. Its IUPAC name is 2-[butyl-(2-ethylcyclohexyl)amino]ethanol.

Molecular Properties

Compound Name2-[butyl-(2-ethylcyclohexyl)amino]ethanol
PubChem CID63861495
Molecular FormulaC14H29NO
Molecular Weight227.39 g/mol
Exact Mass227.22
IUPAC Name2-[butyl-(2-ethylcyclohexyl)amino]ethanol
SMILESCCCCN(CCO)C1CCCCC1CC
InChIInChI=1S/C14H29NO/c1-3-5-10-15(11-12-16)14-9-7-6-8-13(14)4-2/h13-14,16H,3-12H2,1-2H3
InChIKeyHWHSAGCDAYMZFC-UHFFFAOYSA-N
XLogP3.05
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.39
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[butyl-(2-methylcyclopentyl)amino]ethanol
CID 89249359
2-[[2-(aminomethyl)cyclopentyl]-propylamino]ethanol
CID 61424719
4-[butyl-(2-methylcyclooctyl)amino]butan-1-ol
CID 71071404
2-(aminomethyl)-N-butyl-N-ethylcyclohexan-1-amine
CID 43293554
3-[(2-ethylcyclooctyl)-methylamino]propan-1-ol
CID 71071638
2-[cyclopentyl(octyl)amino]ethanol
CID 62015443
trans-(1S,2S)-2-[2-hydroxyethyl(propyl)amino]cyclohexan-1-ol
CID 102731968
2-[[2-(aminomethyl)cyclohexyl]-butylamino]acetamide
CID 55002703
2-(dihexylamino)cyclohexan-1-ol
CID 139882524
3-[butyl(ethyl)amino]-4-ethylcyclohexan-1-ol
CID 165491780
2-[butyl(oxan-4-yl)amino]ethanol
CID 63937119
3-[butyl(cyclopropyl)amino]propan-1-ol
CID 60969534

Frequently Asked Questions

What is the IUPAC name of 2-[butyl-(2-ethylcyclohexyl)amino]ethanol?
The IUPAC name of 2-[butyl-(2-ethylcyclohexyl)amino]ethanol (CID 63861495) is 2-[butyl-(2-ethylcyclohexyl)amino]ethanol.
What is the SMILES notation for 2-[butyl-(2-ethylcyclohexyl)amino]ethanol?
The canonical SMILES for 2-[butyl-(2-ethylcyclohexyl)amino]ethanol is CCCCN(CCO)C1CCCCC1CC.
What is the InChIKey of 2-[butyl-(2-ethylcyclohexyl)amino]ethanol?
The InChIKey is HWHSAGCDAYMZFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO/c1-3-5-10-15(11-12-16)14-9-7-6-8-13(14)4-2/h13-14,16H,3-12H2,1-2H3.
What are the key properties of 2-[butyl-(2-ethylcyclohexyl)amino]ethanol?
2-[butyl-(2-ethylcyclohexyl)amino]ethanol has a molecular weight of 227.39 g/mol, XLogP of 3.05, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[butyl-(2-ethylcyclohexyl)amino]ethanol is sourced from PubChem (CID 63861495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).