(1S,2R,5S)-5-methyl-2-propylcyclohexan-1-ol

C10H20O — CID 11899231

IUPAC(1S,2R,5S)-5-methyl-2-propylcyclohexan-1-ol
SMILESCCC[C@@H]1CC[C@H](C)C[C@@H]1O
InChIInChI=1S/C10H20O/c1-3-4-9-6-5-8(2)7-10(9)11/h8-11H,3-7H2,1-2H3/t8-,9+,10-/m0/s1
InChIKeyVWXNPISBYOISDJ-AEJSXWLSSA-N
MW156.27 g/mol
LogP2.58
Rot. Bonds2

About (1S,2R,5S)-5-methyl-2-propylcyclohexan-1-ol

(1S,2R,5S)-5-methyl-2-propylcyclohexan-1-ol (PubChem CID 11899231) has the molecular formula C10H20O and a molecular weight of 156.27 g/mol. Its IUPAC name is (1S,2R,5S)-5-methyl-2-propylcyclohexan-1-ol.

Molecular Properties

Compound Name(1S,2R,5S)-5-methyl-2-propylcyclohexan-1-ol
PubChem CID11899231
Molecular FormulaC10H20O
Molecular Weight156.27 g/mol
Exact Mass156.15
IUPAC Name(1S,2R,5S)-5-methyl-2-propylcyclohexan-1-ol
SMILESCCC[C@@H]1CC[C@H](C)C[C@@H]1O
InChIInChI=1S/C10H20O/c1-3-4-9-6-5-8(2)7-10(9)11/h8-11H,3-7H2,1-2H3/t8-,9+,10-/m0/s1
InChIKeyVWXNPISBYOISDJ-AEJSXWLSSA-N
XLogP2.58
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5-methyl-2-(3,3,3-trifluoropropyl)cyclohexan-1-ol
CID 102202372
bis(5-methyl-2-propylcyclohexyl)methanone
CID 150034855
2,5-dimethylcyclohexan-1-ol;propane
CID 142087287
2,3,5-trimethyl-1-propylcycloheptane
CID 123381227
(1R)-2-propylcyclohexan-1-ol
CID 144627240
(4-methyl-2-propylcyclohexyl)methanamine
CID 81009866
2-ethyl-5-propylcyclohexan-1-ol
CID 58534322
(1R)-4-methylcyclohexane-1,2-diol
CID 89138285
(1R,2R,5S)-2,5-dimethylcyclohexan-1-ol
CID 12794034
2-methyl-1,3-dipropylcyclopentane
CID 90887551
2-propylcyclohexane-1,4-diol
CID 89257932
2,5-dimethyl-4-propylcyclohexan-1-ol
CID 58534195

Frequently Asked Questions

What is the IUPAC name of (1S,2R,5S)-5-methyl-2-propylcyclohexan-1-ol?
The IUPAC name of (1S,2R,5S)-5-methyl-2-propylcyclohexan-1-ol (CID 11899231) is (1S,2R,5S)-5-methyl-2-propylcyclohexan-1-ol.
What is the SMILES notation for (1S,2R,5S)-5-methyl-2-propylcyclohexan-1-ol?
The canonical SMILES for (1S,2R,5S)-5-methyl-2-propylcyclohexan-1-ol is CCC[C@@H]1CC[C@H](C)C[C@@H]1O.
What is the InChIKey of (1S,2R,5S)-5-methyl-2-propylcyclohexan-1-ol?
The InChIKey is VWXNPISBYOISDJ-AEJSXWLSSA-N. The full InChI is InChI=1S/C10H20O/c1-3-4-9-6-5-8(2)7-10(9)11/h8-11H,3-7H2,1-2H3/t8-,9+,10-/m0/s1.
What are the key properties of (1S,2R,5S)-5-methyl-2-propylcyclohexan-1-ol?
(1S,2R,5S)-5-methyl-2-propylcyclohexan-1-ol has a molecular weight of 156.27 g/mol, XLogP of 2.58, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1S,2R,5S)-5-methyl-2-propylcyclohexan-1-ol is sourced from PubChem (CID 11899231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).