4-ethyl-1-(2-methylbutyl)cyclohexan-1-ol

C13H26O — CID 65147481

IUPAC4-ethyl-1-(2-methylbutyl)cyclohexan-1-ol
SMILESCCC(C)CC1(O)CCC(CC)CC1
InChIInChI=1S/C13H26O/c1-4-11(3)10-13(14)8-6-12(5-2)7-9-13/h11-12,14H,4-10H2,1-3H3
InChIKeyYALKEOFLTKQNKX-UHFFFAOYSA-N
MW198.35 g/mol
LogP3.75
Rot. Bonds4

About 4-ethyl-1-(2-methylbutyl)cyclohexan-1-ol

4-ethyl-1-(2-methylbutyl)cyclohexan-1-ol (PubChem CID 65147481) has the molecular formula C13H26O and a molecular weight of 198.35 g/mol. Its IUPAC name is 4-ethyl-1-(2-methylbutyl)cyclohexan-1-ol.

Molecular Properties

Compound Name4-ethyl-1-(2-methylbutyl)cyclohexan-1-ol
PubChem CID65147481
Molecular FormulaC13H26O
Molecular Weight198.35 g/mol
Exact Mass198.20
IUPAC Name4-ethyl-1-(2-methylbutyl)cyclohexan-1-ol
SMILESCCC(C)CC1(O)CCC(CC)CC1
InChIInChI=1S/C13H26O/c1-4-11(3)10-13(14)8-6-12(5-2)7-9-13/h11-12,14H,4-10H2,1-3H3
InChIKeyYALKEOFLTKQNKX-UHFFFAOYSA-N
XLogP3.75
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.35
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-ethyl-1-(2-methylpentyl)cycloheptan-1-ol
CID 65151311
4-ethyl-1-[(2-methylbutylamino)methyl]cyclohexan-1-ol
CID 65115854
1,3-diethyl-1-(2-methylbutyl)cyclopentane
CID 123267879
1-ethyl-4-[2-(4-ethylcyclohexyl)ethyl]cyclohexan-1-ol
CID 139648654
N-[(4-ethyl-1-hydroxycyclohexyl)methyl]-2-methylpropanamide
CID 65124264
3-ethyl-1-(3-methylbutyl)cyclopentan-1-ol
CID 65154263
1-(2-methylbutyl)-4-propylcyclohexan-1-amine
CID 63407800
4-ethyl-1-(ethylaminomethyl)cyclohexan-1-ol
CID 62773711
4-ethyl-1-(hydroxymethyl)cycloheptan-1-ol
CID 82713966
4-ethyl-1-propan-2-ylcycloheptan-1-ol
CID 65085832
1-decyl-4-ethylcyclohexan-1-ol
CID 65147378
1-but-3-ynyl-4-ethylcycloheptan-1-ol
CID 65085476

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-1-(2-methylbutyl)cyclohexan-1-ol?
The IUPAC name of 4-ethyl-1-(2-methylbutyl)cyclohexan-1-ol (CID 65147481) is 4-ethyl-1-(2-methylbutyl)cyclohexan-1-ol.
What is the SMILES notation for 4-ethyl-1-(2-methylbutyl)cyclohexan-1-ol?
The canonical SMILES for 4-ethyl-1-(2-methylbutyl)cyclohexan-1-ol is CCC(C)CC1(O)CCC(CC)CC1.
What is the InChIKey of 4-ethyl-1-(2-methylbutyl)cyclohexan-1-ol?
The InChIKey is YALKEOFLTKQNKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26O/c1-4-11(3)10-13(14)8-6-12(5-2)7-9-13/h11-12,14H,4-10H2,1-3H3.
What are the key properties of 4-ethyl-1-(2-methylbutyl)cyclohexan-1-ol?
4-ethyl-1-(2-methylbutyl)cyclohexan-1-ol has a molecular weight of 198.35 g/mol, XLogP of 3.75, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-1-(2-methylbutyl)cyclohexan-1-ol is sourced from PubChem (CID 65147481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).