2,3-diethylcyclohexan-1-ol;2,4-diethylcyclohexan-1-ol;2,5-diethylcyclohexan-1-ol;2,6-diethylcyclohexan-1-ol;3,4-diethylcyclohexan-1-ol;3,5-diethylcyclohexan-1-ol;2,4-dipropylcyclohexan-1-ol;2,5-dipropylcyclohexan-1-ol;2,6-dipropylcyclohexan-1-ol

C96H192O9 — CID 158085142

IUPAC2,3-diethylcyclohexan-1-ol;2,4-diethylcyclohexan-1-ol;2,5-diethylcyclohexan-1-ol;2,6-diethylcyclohexan-1-ol;3,4-diethylcyclohexan-1-ol;3,5-diethylcyclohexan-1-ol;2,4-dipropylcyclohexan-1-ol;2,5-dipropylcyclohexan-1-ol;2,6-dipropylcyclohexan-1-ol
SMILESCCC1CC(O)CC(CC)C1.CCC1CCC(CC)C(O)C1.CCC1CCC(O)C(CC)C1.CCC1CCC(O)CC1CC.CCC1CCCC(CC)C1O.CCC1CCCC(O)C1CC.CCCC1CCC(CCC)C(O)C1.CCCC1CCC(O)C(CCC)C1.CCCC1CCCC(CCC)C1O
InChIInChI=1S/3C12H24O.6C10H20O/c1-3-6-10-8-5-9-11(7-4-2)12(10)13;1-3-5-10-7-8-12(13)11(9-10)6-4-2;1-3-5-10-7-8-11(6-4-2)12(13)9-10;1-3-8-5-9(4-2)7-10(11)6-8;1-3-8-5-6-10(11)7-9(8)4-2;1-3-8-5-6-10(11)9(4-2)7-8;1-3-8-5-6-9(4-2)10(11)7-8;1-3-8-6-5-7-10(11)9(8)4-2;1-3-8-6-5-7-9(4-2)10(8)11/h3*10-13H,3-9H2,1-2H3;6*8-11H,3-7H2,1-2H3
InChIKeyFNKRCIQKOLAQJQ-UHFFFAOYSA-N
MW1490.58 g/mol
LogP25.59
Rot. Bonds24

About 2,3-diethylcyclohexan-1-ol;2,4-diethylcyclohexan-1-ol;2,5-diethylcyclohexan-1-ol;2,6-diethylcyclohexan-1-ol;3,4-diethylcyclohexan-1-ol;3,5-diethylcyclohexan-1-ol;2,4-dipropylcyclohexan-1-ol;2,5-dipropylcyclohexan-1-ol;2,6-dipropylcyclohexan-1-ol

2,3-diethylcyclohexan-1-ol;2,4-diethylcyclohexan-1-ol;2,5-diethylcyclohexan-1-ol;2,6-diethylcyclohexan-1-ol;3,4-diethylcyclohexan-1-ol;3,5-diethylcyclohexan-1-ol;2,4-dipropylcyclohexan-1-ol;2,5-dipropylcyclohexan-1-ol;2,6-dipropylcyclohexan-1-ol (PubChem CID 158085142) has the molecular formula C96H192O9 and a molecular weight of 1490.58 g/mol. Its IUPAC name is 2,3-diethylcyclohexan-1-ol;2,4-diethylcyclohexan-1-ol;2,5-diethylcyclohexan-1-ol;2,6-diethylcyclohexan-1-ol;3,4-diethylcyclohexan-1-ol;3,5-diethylcyclohexan-1-ol;2,4-dipropylcyclohexan-1-ol;2,5-dipropylcyclohexan-1-ol;2,6-dipropylcyclohexan-1-ol.

Molecular Properties

Compound Name2,3-diethylcyclohexan-1-ol;2,4-diethylcyclohexan-1-ol;2,5-diethylcyclohexan-1-ol;2,6-diethylcyclohexan-1-ol;3,4-diethylcyclohexan-1-ol;3,5-diethylcyclohexan-1-ol;2,4-dipropylcyclohexan-1-ol;2,5-dipropylcyclohexan-1-ol;2,6-dipropylcyclohexan-1-ol
PubChem CID158085142
Molecular FormulaC96H192O9
Molecular Weight1490.58 g/mol
Exact Mass1489.46
IUPAC Name2,3-diethylcyclohexan-1-ol;2,4-diethylcyclohexan-1-ol;2,5-diethylcyclohexan-1-ol;2,6-diethylcyclohexan-1-ol;3,4-diethylcyclohexan-1-ol;3,5-diethylcyclohexan-1-ol;2,4-dipropylcyclohexan-1-ol;2,5-dipropylcyclohexan-1-ol;2,6-dipropylcyclohexan-1-ol
SMILESCCC1CC(O)CC(CC)C1.CCC1CCC(CC)C(O)C1.CCC1CCC(O)C(CC)C1.CCC1CCC(O)CC1CC.CCC1CCCC(CC)C1O.CCC1CCCC(O)C1CC.CCCC1CCC(CCC)C(O)C1.CCCC1CCC(O)C(CCC)C1.CCCC1CCCC(CCC)C1O
InChIInChI=1S/3C12H24O.6C10H20O/c1-3-6-10-8-5-9-11(7-4-2)12(10)13;1-3-5-10-7-8-12(13)11(9-10)6-4-2;1-3-5-10-7-8-11(6-4-2)12(13)9-10;1-3-8-5-9(4-2)7-10(11)6-8;1-3-8-5-6-10(11)7-9(8)4-2;1-3-8-5-6-10(11)9(4-2)7-8;1-3-8-5-6-9(4-2)10(11)7-8;1-3-8-6-5-7-10(11)9(8)4-2;1-3-8-6-5-7-9(4-2)10(8)11/h3*10-13H,3-9H2,1-2H3;6*8-11H,3-7H2,1-2H3
InChIKeyFNKRCIQKOLAQJQ-UHFFFAOYSA-N
XLogP25.59
TPSA182.07 Ų
H-Bond Donors9
H-Bond Acceptors9
Rotatable Bonds24
Heavy Atoms105
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001490.58
LogP ≤ 525.59
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 109

Analyze 2,3-diethylcyclohexan-1-ol;2,4-diethylcyclohexan-1-ol;2,5-diethylcyclohexan-1-ol;2,6-diethylcyclohexan-1-ol;3,4-diethylcyclohexan-1-ol;3,5-diethylcyclohexan-1-ol;2,4-dipropylcyclohexan-1-ol;2,5-dipropylcyclohexan-1-ol;2,6-dipropylcyclohexan-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

2,5-bis(2-methylpropyl)cyclohexan-1-ol;2,6-bis(2-methylpropyl)cyclohexan-1-ol;2,4-di(butan-2-yl)cyclohexan-1-ol;2,6-di(butan-2-yl)cyclohexan-1-ol;2,5-diethylcyclohexan-1-ol;2-ethyl-3-propylcyclohexan-1-ol;2-ethyl-4-propylcyclohexan-1-ol;2-ethyl-6-propylcyclohexan-1-ol;4-ethyl-2-propylcyclohexan-1-ol;4-ethyl-3-propylcyclohexan-1-ol
CID 161130253
2-ethyl-5-propylcyclohexan-1-ol
CID 58534322
2-propylcyclohexane-1,4-diol
CID 89257932
1-ethyl-3-propylcyclohexane
CID 22129036
(1R)-2-propylcyclohexan-1-ol
CID 144627240
2-ethyl-4-(2-methylpropyl)cyclohexan-1-ol;2-ethyl-5-(2-methylpropyl)cyclohexan-1-ol
CID 158656489
2-(3-hydroxypropyl)-4-propylcyclohexan-1-ol
CID 79422814
2-dodecyl-4-ethylcyclohexan-1-ol
CID 63461251
ethane;2-ethylcyclopentan-1-ol
CID 144624771
4-ethyl-2-(3-hydroxy-3-methylbutyl)cyclohexan-1-ol
CID 79422405
4-ethyl-2-[3-(oxolan-2-yl)propyl]cyclohexan-1-ol
CID 65166209
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

Frequently Asked Questions

What is the IUPAC name of 2,3-diethylcyclohexan-1-ol;2,4-diethylcyclohexan-1-ol;2,5-diethylcyclohexan-1-ol;2,6-diethylcyclohexan-1-ol;3,4-diethylcyclohexan-1-ol;3,5-diethylcyclohexan-1-ol;2,4-dipropylcyclohexan-1-ol;2,5-dipropylcyclohexan-1-ol;2,6-dipropylcyclohexan-1-ol?
The IUPAC name of 2,3-diethylcyclohexan-1-ol;2,4-diethylcyclohexan-1-ol;2,5-diethylcyclohexan-1-ol;2,6-diethylcyclohexan-1-ol;3,4-diethylcyclohexan-1-ol;3,5-diethylcyclohexan-1-ol;2,4-dipropylcyclohexan-1-ol;2,5-dipropylcyclohexan-1-ol;2,6-dipropylcyclohexan-1-ol (CID 158085142) is 2,3-diethylcyclohexan-1-ol;2,4-diethylcyclohexan-1-ol;2,5-diethylcyclohexan-1-ol;2,6-diethylcyclohexan-1-ol;3,4-diethylcyclohexan-1-ol;3,5-diethylcyclohexan-1-ol;2,4-dipropylcyclohexan-1-ol;2,5-dipropylcyclohexan-1-ol;2,6-dipropylcyclohexan-1-ol.
What is the SMILES notation for 2,3-diethylcyclohexan-1-ol;2,4-diethylcyclohexan-1-ol;2,5-diethylcyclohexan-1-ol;2,6-diethylcyclohexan-1-ol;3,4-diethylcyclohexan-1-ol;3,5-diethylcyclohexan-1-ol;2,4-dipropylcyclohexan-1-ol;2,5-dipropylcyclohexan-1-ol;2,6-dipropylcyclohexan-1-ol?
The canonical SMILES for 2,3-diethylcyclohexan-1-ol;2,4-diethylcyclohexan-1-ol;2,5-diethylcyclohexan-1-ol;2,6-diethylcyclohexan-1-ol;3,4-diethylcyclohexan-1-ol;3,5-diethylcyclohexan-1-ol;2,4-dipropylcyclohexan-1-ol;2,5-dipropylcyclohexan-1-ol;2,6-dipropylcyclohexan-1-ol is CCC1CC(O)CC(CC)C1.CCC1CCC(CC)C(O)C1.CCC1CCC(O)C(CC)C1.CCC1CCC(O)CC1CC.CCC1CCCC(CC)C1O.CCC1CCCC(O)C1CC.CCCC1CCC(CCC)C(O)C1.CCCC1CCC(O)C(CCC)C1.CCCC1CCCC(CCC)C1O.
What is the InChIKey of 2,3-diethylcyclohexan-1-ol;2,4-diethylcyclohexan-1-ol;2,5-diethylcyclohexan-1-ol;2,6-diethylcyclohexan-1-ol;3,4-diethylcyclohexan-1-ol;3,5-diethylcyclohexan-1-ol;2,4-dipropylcyclohexan-1-ol;2,5-dipropylcyclohexan-1-ol;2,6-dipropylcyclohexan-1-ol?
The InChIKey is FNKRCIQKOLAQJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/3C12H24O.6C10H20O/c1-3-6-10-8-5-9-11(7-4-2)12(10)13;1-3-5-10-7-8-12(13)11(9-10)6-4-2;1-3-5-10-7-8-11(6-4-2)12(13)9-10;1-3-8-5-9(4-2)7-10(11)6-8;1-3-8-5-6-10(11)7-9(8)4-2;1-3-8-5-6-10(11)9(4-2)7-8;1-3-8-5-6-9(4-2)10(11)7-8;1-3-8-6-5-7-10(11)9(8)4-2;1-3-8-6-5-7-9(4-2)10(8)11/h3*10-13H,3-9H2,1-2H3;6*8-11H,3-7H2,1-2H3.
What are the key properties of 2,3-diethylcyclohexan-1-ol;2,4-diethylcyclohexan-1-ol;2,5-diethylcyclohexan-1-ol;2,6-diethylcyclohexan-1-ol;3,4-diethylcyclohexan-1-ol;3,5-diethylcyclohexan-1-ol;2,4-dipropylcyclohexan-1-ol;2,5-dipropylcyclohexan-1-ol;2,6-dipropylcyclohexan-1-ol?
2,3-diethylcyclohexan-1-ol;2,4-diethylcyclohexan-1-ol;2,5-diethylcyclohexan-1-ol;2,6-diethylcyclohexan-1-ol;3,4-diethylcyclohexan-1-ol;3,5-diethylcyclohexan-1-ol;2,4-dipropylcyclohexan-1-ol;2,5-dipropylcyclohexan-1-ol;2,6-dipropylcyclohexan-1-ol has a molecular weight of 1490.58 g/mol, XLogP of 25.59, 24 rotatable bonds, 9 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-diethylcyclohexan-1-ol;2,4-diethylcyclohexan-1-ol;2,5-diethylcyclohexan-1-ol;2,6-diethylcyclohexan-1-ol;3,4-diethylcyclohexan-1-ol;3,5-diethylcyclohexan-1-ol;2,4-dipropylcyclohexan-1-ol;2,5-dipropylcyclohexan-1-ol;2,6-dipropylcyclohexan-1-ol is sourced from PubChem (CID 158085142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).