1-ethyl-5-methyl-2-propan-2-ylcyclohexan-1-ol

C12H24O — CID 43809223

IUPAC1-ethyl-5-methyl-2-propan-2-ylcyclohexan-1-ol
SMILESCCC1(O)CC(C)CCC1C(C)C
InChIInChI=1S/C12H24O/c1-5-12(13)8-10(4)6-7-11(12)9(2)3/h9-11,13H,5-8H2,1-4H3
InChIKeyDYCABLGCXHCEMN-UHFFFAOYSA-N
MW184.32 g/mol
LogP3.22
Rot. Bonds2

About 1-ethyl-5-methyl-2-propan-2-ylcyclohexan-1-ol

1-ethyl-5-methyl-2-propan-2-ylcyclohexan-1-ol (PubChem CID 43809223) has the molecular formula C12H24O and a molecular weight of 184.32 g/mol. Its IUPAC name is 1-ethyl-5-methyl-2-propan-2-ylcyclohexan-1-ol.

Molecular Properties

Compound Name1-ethyl-5-methyl-2-propan-2-ylcyclohexan-1-ol
PubChem CID43809223
Molecular FormulaC12H24O
Molecular Weight184.32 g/mol
Exact Mass184.18
IUPAC Name1-ethyl-5-methyl-2-propan-2-ylcyclohexan-1-ol
SMILESCCC1(O)CC(C)CCC1C(C)C
InChIInChI=1S/C12H24O/c1-5-12(13)8-10(4)6-7-11(12)9(2)3/h9-11,13H,5-8H2,1-4H3
InChIKeyDYCABLGCXHCEMN-UHFFFAOYSA-N
XLogP3.22
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.32
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-5-methyl-2-propan-2-ylcyclohexan-1-ol?
The IUPAC name of 1-ethyl-5-methyl-2-propan-2-ylcyclohexan-1-ol (CID 43809223) is 1-ethyl-5-methyl-2-propan-2-ylcyclohexan-1-ol.
What is the SMILES notation for 1-ethyl-5-methyl-2-propan-2-ylcyclohexan-1-ol?
The canonical SMILES for 1-ethyl-5-methyl-2-propan-2-ylcyclohexan-1-ol is CCC1(O)CC(C)CCC1C(C)C.
What is the InChIKey of 1-ethyl-5-methyl-2-propan-2-ylcyclohexan-1-ol?
The InChIKey is DYCABLGCXHCEMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24O/c1-5-12(13)8-10(4)6-7-11(12)9(2)3/h9-11,13H,5-8H2,1-4H3.
What are the key properties of 1-ethyl-5-methyl-2-propan-2-ylcyclohexan-1-ol?
1-ethyl-5-methyl-2-propan-2-ylcyclohexan-1-ol has a molecular weight of 184.32 g/mol, XLogP of 3.22, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-5-methyl-2-propan-2-ylcyclohexan-1-ol is sourced from PubChem (CID 43809223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).