1-(1-methylcyclohexyl)-2-propan-2-yloxyethanol

C12H24O2 — CID 106830958

IUPAC1-(1-methylcyclohexyl)-2-propan-2-yloxyethanol
SMILESCC(C)OCC(O)C1(C)CCCCC1
InChIInChI=1S/C12H24O2/c1-10(2)14-9-11(13)12(3)7-5-4-6-8-12/h10-11,13H,4-9H2,1-3H3
InChIKeyPAXACGUFVCRWHO-UHFFFAOYSA-N
MW200.32 g/mol
LogP2.74
Rot. Bonds4

About 1-(1-methylcyclohexyl)-2-propan-2-yloxyethanol

1-(1-methylcyclohexyl)-2-propan-2-yloxyethanol (PubChem CID 106830958) has the molecular formula C12H24O2 and a molecular weight of 200.32 g/mol. Its IUPAC name is 1-(1-methylcyclohexyl)-2-propan-2-yloxyethanol.

Molecular Properties

Compound Name1-(1-methylcyclohexyl)-2-propan-2-yloxyethanol
PubChem CID106830958
Molecular FormulaC12H24O2
Molecular Weight200.32 g/mol
Exact Mass200.18
IUPAC Name1-(1-methylcyclohexyl)-2-propan-2-yloxyethanol
SMILESCC(C)OCC(O)C1(C)CCCCC1
InChIInChI=1S/C12H24O2/c1-10(2)14-9-11(13)12(3)7-5-4-6-8-12/h10-11,13H,4-9H2,1-3H3
InChIKeyPAXACGUFVCRWHO-UHFFFAOYSA-N
XLogP2.74
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.32
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(1-ethylcyclopentyl)-2-propan-2-yloxyethanol
CID 115821425
2-cyclohexyl-1-(1-methylcyclopentyl)ethanol
CID 115786279
1-(1-methylcyclopentyl)heptan-1-ol
CID 115783527
1-(1-methylcyclopentyl)nonan-1-ol
CID 115784043
1-[chloro(propan-2-yloxy)methyl]-1-methylcyclohexane
CID 89304186
1-[[(2-hydroxy-3-propan-2-yloxypropyl)amino]methyl]cycloheptan-1-ol
CID 65122217
1-(2-methyloxan-2-yl)-2-propan-2-yloxyethanamine
CID 80683812
1-(2-hydroxy-3-propan-2-yloxypropyl)-4-methylpiperidin-4-ol
CID 115826056
1-[[(2-hydroxy-3-propan-2-yloxypropyl)amino]methyl]cyclopentan-1-ol
CID 65109325
1-(8-azaspiro[4.5]decan-8-yl)-3-propan-2-yloxypropan-2-ol
CID 63987208
1-(2,2-dimethylpyrrolidin-1-yl)-3-propan-2-yloxypropan-2-ol
CID 63222062
1-(2-propan-2-yloxyethoxy)cycloheptane-1-carboxylic acid
CID 114994306

Frequently Asked Questions

What is the IUPAC name of 1-(1-methylcyclohexyl)-2-propan-2-yloxyethanol?
The IUPAC name of 1-(1-methylcyclohexyl)-2-propan-2-yloxyethanol (CID 106830958) is 1-(1-methylcyclohexyl)-2-propan-2-yloxyethanol.
What is the SMILES notation for 1-(1-methylcyclohexyl)-2-propan-2-yloxyethanol?
The canonical SMILES for 1-(1-methylcyclohexyl)-2-propan-2-yloxyethanol is CC(C)OCC(O)C1(C)CCCCC1.
What is the InChIKey of 1-(1-methylcyclohexyl)-2-propan-2-yloxyethanol?
The InChIKey is PAXACGUFVCRWHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24O2/c1-10(2)14-9-11(13)12(3)7-5-4-6-8-12/h10-11,13H,4-9H2,1-3H3.
What are the key properties of 1-(1-methylcyclohexyl)-2-propan-2-yloxyethanol?
1-(1-methylcyclohexyl)-2-propan-2-yloxyethanol has a molecular weight of 200.32 g/mol, XLogP of 2.74, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methylcyclohexyl)-2-propan-2-yloxyethanol is sourced from PubChem (CID 106830958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).