3-butyl-2-methylcyclohexan-1-ol;4-butyl-2-methylcyclohexan-1-ol;5-butyl-2-methylcyclohexan-1-ol;3-methyl-2-propan-2-ylcyclohexan-1-ol;3-methyl-4-propan-2-ylcyclohexan-1-ol;3-methyl-5-propan-2-ylcyclohexan-1-ol;4-methyl-2-propan-2-ylcyclohexan-1-ol;4-methyl-3-propan-2-ylcyclohexan-1-ol

C83H166O8 — CID 160560393

IUPAC3-butyl-2-methylcyclohexan-1-ol;4-butyl-2-methylcyclohexan-1-ol;5-butyl-2-methylcyclohexan-1-ol;3-methyl-2-propan-2-ylcyclohexan-1-ol;3-methyl-4-propan-2-ylcyclohexan-1-ol;3-methyl-5-propan-2-ylcyclohexan-1-ol;4-methyl-2-propan-2-ylcyclohexan-1-ol;4-methyl-3-propan-2-ylcyclohexan-1-ol
SMILESCC(C)C1C(C)CCCC1O.CC(C)C1CC(O)CCC1C.CC(C)C1CCC(O)CC1C.CC1CC(O)CC(C(C)C)C1.CC1CCC(O)C(C(C)C)C1.CCCCC1CCC(C)C(O)C1.CCCCC1CCC(O)C(C)C1.CCCCC1CCCC(O)C1C
InChIInChI=1S/3C11H22O.5C10H20O/c1-3-4-6-10-7-5-8-11(12)9(10)2;1-3-4-5-10-6-7-11(12)9(2)8-10;1-3-4-5-10-7-6-9(2)11(12)8-10;1-7(2)9-4-8(3)5-10(11)6-9;1-7(2)10-5-4-9(11)6-8(10)3;1-7(2)10-6-9(11)5-4-8(10)3;1-7(2)9-6-8(3)4-5-10(9)11;1-7(2)10-8(3)5-4-6-9(10)11/h3*9-12H,3-8H2,1-2H3;5*7-11H,4-6H2,1-3H3
InChIKeyQZFPEFBQNINQFN-UHFFFAOYSA-N
MW1292.23 g/mol
LogP21.12
Rot. Bonds14

About 3-butyl-2-methylcyclohexan-1-ol;4-butyl-2-methylcyclohexan-1-ol;5-butyl-2-methylcyclohexan-1-ol;3-methyl-2-propan-2-ylcyclohexan-1-ol;3-methyl-4-propan-2-ylcyclohexan-1-ol;3-methyl-5-propan-2-ylcyclohexan-1-ol;4-methyl-2-propan-2-ylcyclohexan-1-ol;4-methyl-3-propan-2-ylcyclohexan-1-ol

3-butyl-2-methylcyclohexan-1-ol;4-butyl-2-methylcyclohexan-1-ol;5-butyl-2-methylcyclohexan-1-ol;3-methyl-2-propan-2-ylcyclohexan-1-ol;3-methyl-4-propan-2-ylcyclohexan-1-ol;3-methyl-5-propan-2-ylcyclohexan-1-ol;4-methyl-2-propan-2-ylcyclohexan-1-ol;4-methyl-3-propan-2-ylcyclohexan-1-ol (PubChem CID 160560393) has the molecular formula C83H166O8 and a molecular weight of 1292.23 g/mol. Its IUPAC name is 3-butyl-2-methylcyclohexan-1-ol;4-butyl-2-methylcyclohexan-1-ol;5-butyl-2-methylcyclohexan-1-ol;3-methyl-2-propan-2-ylcyclohexan-1-ol;3-methyl-4-propan-2-ylcyclohexan-1-ol;3-methyl-5-propan-2-ylcyclohexan-1-ol;4-methyl-2-propan-2-ylcyclohexan-1-ol;4-methyl-3-propan-2-ylcyclohexan-1-ol.

Molecular Properties

Compound Name3-butyl-2-methylcyclohexan-1-ol;4-butyl-2-methylcyclohexan-1-ol;5-butyl-2-methylcyclohexan-1-ol;3-methyl-2-propan-2-ylcyclohexan-1-ol;3-methyl-4-propan-2-ylcyclohexan-1-ol;3-methyl-5-propan-2-ylcyclohexan-1-ol;4-methyl-2-propan-2-ylcyclohexan-1-ol;4-methyl-3-propan-2-ylcyclohexan-1-ol
PubChem CID160560393
Molecular FormulaC83H166O8
Molecular Weight1292.23 g/mol
Exact Mass1291.26
IUPAC Name3-butyl-2-methylcyclohexan-1-ol;4-butyl-2-methylcyclohexan-1-ol;5-butyl-2-methylcyclohexan-1-ol;3-methyl-2-propan-2-ylcyclohexan-1-ol;3-methyl-4-propan-2-ylcyclohexan-1-ol;3-methyl-5-propan-2-ylcyclohexan-1-ol;4-methyl-2-propan-2-ylcyclohexan-1-ol;4-methyl-3-propan-2-ylcyclohexan-1-ol
SMILESCC(C)C1C(C)CCCC1O.CC(C)C1CC(O)CCC1C.CC(C)C1CCC(O)CC1C.CC1CC(O)CC(C(C)C)C1.CC1CCC(O)C(C(C)C)C1.CCCCC1CCC(C)C(O)C1.CCCCC1CCC(O)C(C)C1.CCCCC1CCCC(O)C1C
InChIInChI=1S/3C11H22O.5C10H20O/c1-3-4-6-10-7-5-8-11(12)9(10)2;1-3-4-5-10-6-7-11(12)9(2)8-10;1-3-4-5-10-7-6-9(2)11(12)8-10;1-7(2)9-4-8(3)5-10(11)6-9;1-7(2)10-5-4-9(11)6-8(10)3;1-7(2)10-6-9(11)5-4-8(10)3;1-7(2)9-6-8(3)4-5-10(9)11;1-7(2)10-8(3)5-4-6-9(10)11/h3*9-12H,3-8H2,1-2H3;5*7-11H,4-6H2,1-3H3
InChIKeyQZFPEFBQNINQFN-UHFFFAOYSA-N
XLogP21.12
TPSA161.84 Ų
H-Bond Donors8
H-Bond Acceptors8
Rotatable Bonds14
Heavy Atoms91
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001292.23
LogP ≤ 521.12
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 108

Analyze 3-butyl-2-methylcyclohexan-1-ol;4-butyl-2-methylcyclohexan-1-ol;5-butyl-2-methylcyclohexan-1-ol;3-methyl-2-propan-2-ylcyclohexan-1-ol;3-methyl-4-propan-2-ylcyclohexan-1-ol;3-methyl-5-propan-2-ylcyclohexan-1-ol;4-methyl-2-propan-2-ylcyclohexan-1-ol;4-methyl-3-propan-2-ylcyclohexan-1-ol 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

2-ethyl-6-methylcyclohexan-1-ol;5-ethyl-2-methylcyclohexan-1-ol;2-methyl-3-propan-2-ylcyclohexan-1-ol;2-methyl-4-propan-2-ylcyclohexan-1-ol;2-methyl-5-propan-2-ylcyclohexan-1-ol;2-methyl-6-propan-2-ylcyclohexan-1-ol;3-methyl-2-propan-2-ylcyclohexan-1-ol;3-methyl-4-propan-2-ylcyclohexan-1-ol
CID 160934332
(2S)-2-methyl-4-propylcyclohexan-1-ol
CID 177268723
(1S,2S,4R)-4-methyl-2-propan-2-ylcyclohexan-1-ol
CID 15605903
(1S,3S,4R)-3-methyl-4-propan-2-ylcyclohexan-1-ol
CID 176720342
2,3-dibutylcyclohexan-1-ol;2,4-dibutylcyclohexan-1-ol;2,4-ditert-butylcyclohexan-1-ol;2,5-dibutylcyclohexan-1-ol;2,5-ditert-butylcyclohexan-1-ol;2,6-ditert-butylcyclohexan-1-ol;2,4-di(propan-2-yl)cyclohexan-1-ol;2,6-di(propan-2-yl)cyclohexan-1-ol
CID 158250058
6-butyl-3-methylcycloheptane-1,2-diol
CID 123314380
1-methyl-3-propan-2-ylcyclopentane;3-propan-2-ylcyclobutan-1-ol
CID 158535526
(2R)-1,4-dimethyl-2-propan-2-ylcyclohexane
CID 149206895
1,5-dimethyl-3-[5-(3-methyl-2-propan-2-ylcyclohexyl)pentyl]-2-propan-2-ylcyclohexane
CID 91227488
4-butyl-2,3-dimethylcyclohexan-1-ol
CID 58534220
2-ethyl-2-methylcyclohexan-1-ol;2-ethyl-4-methylcyclohexan-1-ol;3-ethyl-2-methylcyclohexan-1-ol;3-ethyl-3-methylcyclohexan-1-ol;3-ethyl-4-methylcyclohexan-1-ol;4-ethyl-2-methylcyclohexan-1-ol;4-ethyl-4-methylcyclohexan-1-ol;2-methyl-3-propylcyclohexan-1-ol;2-methyl-4-propylcyclohexan-1-ol
CID 159319770
CID 66630118
CID 66630118

Frequently Asked Questions

What is the IUPAC name of 3-butyl-2-methylcyclohexan-1-ol;4-butyl-2-methylcyclohexan-1-ol;5-butyl-2-methylcyclohexan-1-ol;3-methyl-2-propan-2-ylcyclohexan-1-ol;3-methyl-4-propan-2-ylcyclohexan-1-ol;3-methyl-5-propan-2-ylcyclohexan-1-ol;4-methyl-2-propan-2-ylcyclohexan-1-ol;4-methyl-3-propan-2-ylcyclohexan-1-ol?
The IUPAC name of 3-butyl-2-methylcyclohexan-1-ol;4-butyl-2-methylcyclohexan-1-ol;5-butyl-2-methylcyclohexan-1-ol;3-methyl-2-propan-2-ylcyclohexan-1-ol;3-methyl-4-propan-2-ylcyclohexan-1-ol;3-methyl-5-propan-2-ylcyclohexan-1-ol;4-methyl-2-propan-2-ylcyclohexan-1-ol;4-methyl-3-propan-2-ylcyclohexan-1-ol (CID 160560393) is 3-butyl-2-methylcyclohexan-1-ol;4-butyl-2-methylcyclohexan-1-ol;5-butyl-2-methylcyclohexan-1-ol;3-methyl-2-propan-2-ylcyclohexan-1-ol;3-methyl-4-propan-2-ylcyclohexan-1-ol;3-methyl-5-propan-2-ylcyclohexan-1-ol;4-methyl-2-propan-2-ylcyclohexan-1-ol;4-methyl-3-propan-2-ylcyclohexan-1-ol.
What is the SMILES notation for 3-butyl-2-methylcyclohexan-1-ol;4-butyl-2-methylcyclohexan-1-ol;5-butyl-2-methylcyclohexan-1-ol;3-methyl-2-propan-2-ylcyclohexan-1-ol;3-methyl-4-propan-2-ylcyclohexan-1-ol;3-methyl-5-propan-2-ylcyclohexan-1-ol;4-methyl-2-propan-2-ylcyclohexan-1-ol;4-methyl-3-propan-2-ylcyclohexan-1-ol?
The canonical SMILES for 3-butyl-2-methylcyclohexan-1-ol;4-butyl-2-methylcyclohexan-1-ol;5-butyl-2-methylcyclohexan-1-ol;3-methyl-2-propan-2-ylcyclohexan-1-ol;3-methyl-4-propan-2-ylcyclohexan-1-ol;3-methyl-5-propan-2-ylcyclohexan-1-ol;4-methyl-2-propan-2-ylcyclohexan-1-ol;4-methyl-3-propan-2-ylcyclohexan-1-ol is CC(C)C1C(C)CCCC1O.CC(C)C1CC(O)CCC1C.CC(C)C1CCC(O)CC1C.CC1CC(O)CC(C(C)C)C1.CC1CCC(O)C(C(C)C)C1.CCCCC1CCC(C)C(O)C1.CCCCC1CCC(O)C(C)C1.CCCCC1CCCC(O)C1C.
What is the InChIKey of 3-butyl-2-methylcyclohexan-1-ol;4-butyl-2-methylcyclohexan-1-ol;5-butyl-2-methylcyclohexan-1-ol;3-methyl-2-propan-2-ylcyclohexan-1-ol;3-methyl-4-propan-2-ylcyclohexan-1-ol;3-methyl-5-propan-2-ylcyclohexan-1-ol;4-methyl-2-propan-2-ylcyclohexan-1-ol;4-methyl-3-propan-2-ylcyclohexan-1-ol?
The InChIKey is QZFPEFBQNINQFN-UHFFFAOYSA-N. The full InChI is InChI=1S/3C11H22O.5C10H20O/c1-3-4-6-10-7-5-8-11(12)9(10)2;1-3-4-5-10-6-7-11(12)9(2)8-10;1-3-4-5-10-7-6-9(2)11(12)8-10;1-7(2)9-4-8(3)5-10(11)6-9;1-7(2)10-5-4-9(11)6-8(10)3;1-7(2)10-6-9(11)5-4-8(10)3;1-7(2)9-6-8(3)4-5-10(9)11;1-7(2)10-8(3)5-4-6-9(10)11/h3*9-12H,3-8H2,1-2H3;5*7-11H,4-6H2,1-3H3.
What are the key properties of 3-butyl-2-methylcyclohexan-1-ol;4-butyl-2-methylcyclohexan-1-ol;5-butyl-2-methylcyclohexan-1-ol;3-methyl-2-propan-2-ylcyclohexan-1-ol;3-methyl-4-propan-2-ylcyclohexan-1-ol;3-methyl-5-propan-2-ylcyclohexan-1-ol;4-methyl-2-propan-2-ylcyclohexan-1-ol;4-methyl-3-propan-2-ylcyclohexan-1-ol?
3-butyl-2-methylcyclohexan-1-ol;4-butyl-2-methylcyclohexan-1-ol;5-butyl-2-methylcyclohexan-1-ol;3-methyl-2-propan-2-ylcyclohexan-1-ol;3-methyl-4-propan-2-ylcyclohexan-1-ol;3-methyl-5-propan-2-ylcyclohexan-1-ol;4-methyl-2-propan-2-ylcyclohexan-1-ol;4-methyl-3-propan-2-ylcyclohexan-1-ol has a molecular weight of 1292.23 g/mol, XLogP of 21.12, 14 rotatable bonds, 8 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 3-butyl-2-methylcyclohexan-1-ol;4-butyl-2-methylcyclohexan-1-ol;5-butyl-2-methylcyclohexan-1-ol;3-methyl-2-propan-2-ylcyclohexan-1-ol;3-methyl-4-propan-2-ylcyclohexan-1-ol;3-methyl-5-propan-2-ylcyclohexan-1-ol;4-methyl-2-propan-2-ylcyclohexan-1-ol;4-methyl-3-propan-2-ylcyclohexan-1-ol is sourced from PubChem (CID 160560393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).