3-ethyl-1-(4-methylcyclohexyl)heptan-1-ol

C16H32O — CID 63410678

IUPAC3-ethyl-1-(4-methylcyclohexyl)heptan-1-ol
SMILESCCCCC(CC)CC(O)C1CCC(C)CC1
InChIInChI=1S/C16H32O/c1-4-6-7-14(5-2)12-16(17)15-10-8-13(3)9-11-15/h13-17H,4-12H2,1-3H3
InChIKeyWKXVIEWWENKMKA-UHFFFAOYSA-N
MW240.43 g/mol
LogP4.78
Rot. Bonds7

About 3-ethyl-1-(4-methylcyclohexyl)heptan-1-ol

3-ethyl-1-(4-methylcyclohexyl)heptan-1-ol (PubChem CID 63410678) has the molecular formula C16H32O and a molecular weight of 240.43 g/mol. Its IUPAC name is 3-ethyl-1-(4-methylcyclohexyl)heptan-1-ol.

Molecular Properties

Compound Name3-ethyl-1-(4-methylcyclohexyl)heptan-1-ol
PubChem CID63410678
Molecular FormulaC16H32O
Molecular Weight240.43 g/mol
Exact Mass240.25
IUPAC Name3-ethyl-1-(4-methylcyclohexyl)heptan-1-ol
SMILESCCCCC(CC)CC(O)C1CCC(C)CC1
InChIInChI=1S/C16H32O/c1-4-6-7-14(5-2)12-16(17)15-10-8-13(3)9-11-15/h13-17H,4-12H2,1-3H3
InChIKeyWKXVIEWWENKMKA-UHFFFAOYSA-N
XLogP4.78
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.43
LogP ≤ 54.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 3-ethyl-1-(4-methylcyclohexyl)heptan-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

3-ethyl-1-(4-propan-2-ylcyclohexyl)heptan-1-ol
CID 65425475
1-(4-butylcyclohexyl)-3-ethylheptan-1-ol
CID 114981328
3-ethyl-1-(thiolan-3-yl)heptan-1-ol
CID 105080644
1-cyclopropylheptane-1,3-diol
CID 174466446
[3-ethyl-1-(4-methylcyclohexyl)heptyl]hydrazine
CID 105210540
1-cyclopropylpentan-1-ol
CID 551238
3-butoxy-1-(4-methylcyclohexyl)propan-1-ol
CID 115003111
(2R,4S)-4-ethyloctan-2-ol
CID 7015159
5,9-diethyl-7-(2-ethylpentyl)tridecane
CID 170533070
1-cyclopropyl-3-ethyl-N-propylheptan-1-amine
CID 63413488
1-cyclopropylheptan-1-ol
CID 10909821
1-cyclopropyltridecan-1-ol
CID 63410999

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-(4-methylcyclohexyl)heptan-1-ol?
The IUPAC name of 3-ethyl-1-(4-methylcyclohexyl)heptan-1-ol (CID 63410678) is 3-ethyl-1-(4-methylcyclohexyl)heptan-1-ol.
What is the SMILES notation for 3-ethyl-1-(4-methylcyclohexyl)heptan-1-ol?
The canonical SMILES for 3-ethyl-1-(4-methylcyclohexyl)heptan-1-ol is CCCCC(CC)CC(O)C1CCC(C)CC1.
What is the InChIKey of 3-ethyl-1-(4-methylcyclohexyl)heptan-1-ol?
The InChIKey is WKXVIEWWENKMKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32O/c1-4-6-7-14(5-2)12-16(17)15-10-8-13(3)9-11-15/h13-17H,4-12H2,1-3H3.
What are the key properties of 3-ethyl-1-(4-methylcyclohexyl)heptan-1-ol?
3-ethyl-1-(4-methylcyclohexyl)heptan-1-ol has a molecular weight of 240.43 g/mol, XLogP of 4.78, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-(4-methylcyclohexyl)heptan-1-ol is sourced from PubChem (CID 63410678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).