2-[cyclohexyl(2-ethylbutyl)amino]ethanol

C14H29NO — CID 82930046

IUPAC2-[cyclohexyl(2-ethylbutyl)amino]ethanol
SMILESCCC(CC)CN(CCO)C1CCCCC1
InChIInChI=1S/C14H29NO/c1-3-13(4-2)12-15(10-11-16)14-8-6-5-7-9-14/h13-14,16H,3-12H2,1-2H3
InChIKeyRGQGVIDXHADBLG-UHFFFAOYSA-N
MW227.39 g/mol
LogP3.05
Rot. Bonds7

About 2-[cyclohexyl(2-ethylbutyl)amino]ethanol

2-[cyclohexyl(2-ethylbutyl)amino]ethanol (PubChem CID 82930046) has the molecular formula C14H29NO and a molecular weight of 227.39 g/mol. Its IUPAC name is 2-[cyclohexyl(2-ethylbutyl)amino]ethanol.

Molecular Properties

Compound Name2-[cyclohexyl(2-ethylbutyl)amino]ethanol
PubChem CID82930046
Molecular FormulaC14H29NO
Molecular Weight227.39 g/mol
Exact Mass227.22
IUPAC Name2-[cyclohexyl(2-ethylbutyl)amino]ethanol
SMILESCCC(CC)CN(CCO)C1CCCCC1
InChIInChI=1S/C14H29NO/c1-3-13(4-2)12-15(10-11-16)14-8-6-5-7-9-14/h13-14,16H,3-12H2,1-2H3
InChIKeyRGQGVIDXHADBLG-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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Frequently Asked Questions

What is the IUPAC name of 2-[cyclohexyl(2-ethylbutyl)amino]ethanol?
The IUPAC name of 2-[cyclohexyl(2-ethylbutyl)amino]ethanol (CID 82930046) is 2-[cyclohexyl(2-ethylbutyl)amino]ethanol.
What is the SMILES notation for 2-[cyclohexyl(2-ethylbutyl)amino]ethanol?
The canonical SMILES for 2-[cyclohexyl(2-ethylbutyl)amino]ethanol is CCC(CC)CN(CCO)C1CCCCC1.
What is the InChIKey of 2-[cyclohexyl(2-ethylbutyl)amino]ethanol?
The InChIKey is RGQGVIDXHADBLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO/c1-3-13(4-2)12-15(10-11-16)14-8-6-5-7-9-14/h13-14,16H,3-12H2,1-2H3.
What are the key properties of 2-[cyclohexyl(2-ethylbutyl)amino]ethanol?
2-[cyclohexyl(2-ethylbutyl)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-[cyclohexyl(2-ethylbutyl)amino]ethanol is sourced from PubChem (CID 82930046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).