ethane;2-methylcyclohexan-1-ol;2-methylcyclopentan-1-ol

C17H38O2 — CID 157029785

IUPACethane;2-methylcyclohexan-1-ol;2-methylcyclopentan-1-ol
SMILESCC.CC.CC1CCCC1O.CC1CCCCC1O
InChIInChI=1S/C7H14O.C6H12O.2C2H6/c1-6-4-2-3-5-7(6)8;1-5-3-2-4-6(5)7;2*1-2/h6-8H,2-5H2,1H3;5-7H,2-4H2,1H3;2*1-2H3
InChIKeyYSEBGSPDGHTENS-UHFFFAOYSA-N
MW274.49 g/mol
LogP4.78
Rot. Bonds

About ethane;2-methylcyclohexan-1-ol;2-methylcyclopentan-1-ol

ethane;2-methylcyclohexan-1-ol;2-methylcyclopentan-1-ol (PubChem CID 157029785) has the molecular formula C17H38O2 and a molecular weight of 274.49 g/mol. Its IUPAC name is ethane;2-methylcyclohexan-1-ol;2-methylcyclopentan-1-ol.

Molecular Properties

Compound Nameethane;2-methylcyclohexan-1-ol;2-methylcyclopentan-1-ol
PubChem CID157029785
Molecular FormulaC17H38O2
Molecular Weight274.49 g/mol
Exact Mass274.29
IUPAC Nameethane;2-methylcyclohexan-1-ol;2-methylcyclopentan-1-ol
SMILESCC.CC.CC1CCCC1O.CC1CCCCC1O
InChIInChI=1S/C7H14O.C6H12O.2C2H6/c1-6-4-2-3-5-7(6)8;1-5-3-2-4-6(5)7;2*1-2/h6-8H,2-5H2,1H3;5-7H,2-4H2,1H3;2*1-2H3
InChIKeyYSEBGSPDGHTENS-UHFFFAOYSA-N
XLogP4.78
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.49
LogP ≤ 54.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;(1R)-2-methylcyclohexan-1-ol
CID 142359109
ethane;trans-(1S,2S)-2-methylcyclohexan-1-ol
CID 143642035
cis-(1S,2R)-2-methylcyclopentan-1-ol
CID 642631
2-methylcyclododecan-1-ol
CID 13130078
acetic acid;2-methylcyclopentan-1-ol
CID 71356720
(2S)-2,3-dimethylcyclohexan-1-ol
CID 163715322
ethane;trans-(1R,2R)-1,2-dimethylcyclopentane
CID 91129712
(1S,2R,3R)-2-amino-3-methylcyclohexan-1-ol
CID 90137025
(1R,2R,5R)-2-methyl-5-prop-1-en-2-ylcyclohexan-1-ol;trans-(1R,2R)-2-methylcyclohexan-1-ol
CID 165066222
cis-(1S,2R)-2-[[(1R,2S)-2-methylcyclopentyl]amino]cyclohexan-1-ol
CID 95377487
carbon dioxide;methane;methanol;2-methylcyclohexan-1-ol;7-oxabicyclo[4.1.0]heptane
CID 162180777
trans-(1R,2R)-2-methylcyclohexan-1-ol;trifluoromethylsulfonyl trifluoromethanesulfonate
CID 91351531

Frequently Asked Questions

What is the IUPAC name of ethane;2-methylcyclohexan-1-ol;2-methylcyclopentan-1-ol?
The IUPAC name of ethane;2-methylcyclohexan-1-ol;2-methylcyclopentan-1-ol (CID 157029785) is ethane;2-methylcyclohexan-1-ol;2-methylcyclopentan-1-ol.
What is the SMILES notation for ethane;2-methylcyclohexan-1-ol;2-methylcyclopentan-1-ol?
The canonical SMILES for ethane;2-methylcyclohexan-1-ol;2-methylcyclopentan-1-ol is CC.CC.CC1CCCC1O.CC1CCCCC1O.
What is the InChIKey of ethane;2-methylcyclohexan-1-ol;2-methylcyclopentan-1-ol?
The InChIKey is YSEBGSPDGHTENS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14O.C6H12O.2C2H6/c1-6-4-2-3-5-7(6)8;1-5-3-2-4-6(5)7;2*1-2/h6-8H,2-5H2,1H3;5-7H,2-4H2,1H3;2*1-2H3.
What are the key properties of ethane;2-methylcyclohexan-1-ol;2-methylcyclopentan-1-ol?
ethane;2-methylcyclohexan-1-ol;2-methylcyclopentan-1-ol has a molecular weight of 274.49 g/mol, XLogP of 4.78, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-methylcyclohexan-1-ol;2-methylcyclopentan-1-ol is sourced from PubChem (CID 157029785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).