2-[cyclobutylmethyl(ethyl)amino]-1-cyclohexylethanol

C15H29NO — CID 107400916

IUPAC2-[cyclobutylmethyl(ethyl)amino]-1-cyclohexylethanol
SMILESCCN(CC1CCC1)CC(O)C1CCCCC1
InChIInChI=1S/C15H29NO/c1-2-16(11-13-7-6-8-13)12-15(17)14-9-4-3-5-10-14/h13-15,17H,2-12H2,1H3
InChIKeyHHZCCXMAIXBIMT-UHFFFAOYSA-N
MW239.40 g/mol
LogP3.05
Rot. Bonds6

About 2-[cyclobutylmethyl(ethyl)amino]-1-cyclohexylethanol

2-[cyclobutylmethyl(ethyl)amino]-1-cyclohexylethanol (PubChem CID 107400916) has the molecular formula C15H29NO and a molecular weight of 239.40 g/mol. Its IUPAC name is 2-[cyclobutylmethyl(ethyl)amino]-1-cyclohexylethanol.

Molecular Properties

Compound Name2-[cyclobutylmethyl(ethyl)amino]-1-cyclohexylethanol
PubChem CID107400916
Molecular FormulaC15H29NO
Molecular Weight239.40 g/mol
Exact Mass239.22
IUPAC Name2-[cyclobutylmethyl(ethyl)amino]-1-cyclohexylethanol
SMILESCCN(CC1CCC1)CC(O)C1CCCCC1
InChIInChI=1S/C15H29NO/c1-2-16(11-13-7-6-8-13)12-15(17)14-9-4-3-5-10-14/h13-15,17H,2-12H2,1H3
InChIKeyHHZCCXMAIXBIMT-UHFFFAOYSA-N
XLogP3.05
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.40
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[cyclobutylmethyl(ethyl)amino]propane-1,2-diol
CID 107400463
1-[cyclobutylmethyl(ethyl)amino]propan-2-ol
CID 103714006
1-cyclopentyl-2-[ethyl(oxolan-2-ylmethyl)amino]ethanol
CID 104752617
2-[cyclohexylmethyl(methyl)amino]-1-cyclopropylethanol
CID 63906781
N'-(cyclohexylmethyl)-N,N,N'-triethylethane-1,2-diamine
CID 2058149
1-cyclopentyl-N'-(cyclopropylmethyl)-N,N'-diethylethane-1,2-diamine
CID 104746400
3-[cyclobutylmethyl(ethyl)amino]-N'-hydroxy-2-methylpropanimidamide
CID 77067837
1-N-(cyclobutylmethyl)-1-N,2-N-diethylbutane-1,2-diamine
CID 107397983
N'-(cyclobutylmethyl)-N-cyclohexyl-N'-ethylethane-1,2-diamine
CID 107402209
1-cyclopentyl-2-[methyl(oxan-4-ylmethyl)amino]ethanol
CID 104752909
1-cyclohexyl-2-[ethyl(1-methoxypropan-2-yl)amino]ethanol
CID 113449107
3-[cyclobutylmethyl(ethyl)amino]propan-1-ol
CID 115666204

Frequently Asked Questions

What is the IUPAC name of 2-[cyclobutylmethyl(ethyl)amino]-1-cyclohexylethanol?
The IUPAC name of 2-[cyclobutylmethyl(ethyl)amino]-1-cyclohexylethanol (CID 107400916) is 2-[cyclobutylmethyl(ethyl)amino]-1-cyclohexylethanol.
What is the SMILES notation for 2-[cyclobutylmethyl(ethyl)amino]-1-cyclohexylethanol?
The canonical SMILES for 2-[cyclobutylmethyl(ethyl)amino]-1-cyclohexylethanol is CCN(CC1CCC1)CC(O)C1CCCCC1.
What is the InChIKey of 2-[cyclobutylmethyl(ethyl)amino]-1-cyclohexylethanol?
The InChIKey is HHZCCXMAIXBIMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO/c1-2-16(11-13-7-6-8-13)12-15(17)14-9-4-3-5-10-14/h13-15,17H,2-12H2,1H3.
What are the key properties of 2-[cyclobutylmethyl(ethyl)amino]-1-cyclohexylethanol?
2-[cyclobutylmethyl(ethyl)amino]-1-cyclohexylethanol has a molecular weight of 239.40 g/mol, XLogP of 3.05, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclobutylmethyl(ethyl)amino]-1-cyclohexylethanol is sourced from PubChem (CID 107400916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).