(S)-cyclohexyl-[(1R,5R)-5-methylcyclohex-2-en-1-yl]methanol

C14H24O — CID 101050160

IUPAC(S)-cyclohexyl-[(1R,5R)-5-methylcyclohex-2-en-1-yl]methanol
SMILESC[C@@H]1CC=C[C@H]([C@@H](O)C2CCCCC2)C1
InChIInChI=1S/C14H24O/c1-11-6-5-9-13(10-11)14(15)12-7-3-2-4-8-12/h5,9,11-15H,2-4,6-8,10H2,1H3/t11-,13+,14+/m1/s1
InChIKeyHHXGPLRQKQVDKY-XBFCOCLRSA-N
MW208.34 g/mol
LogP3.53
Rot. Bonds2

About (S)-cyclohexyl-[(1R,5R)-5-methylcyclohex-2-en-1-yl]methanol

(S)-cyclohexyl-[(1R,5R)-5-methylcyclohex-2-en-1-yl]methanol (PubChem CID 101050160) has the molecular formula C14H24O and a molecular weight of 208.34 g/mol. Its IUPAC name is (S)-cyclohexyl-[(1R,5R)-5-methylcyclohex-2-en-1-yl]methanol.

Molecular Properties

Compound Name(S)-cyclohexyl-[(1R,5R)-5-methylcyclohex-2-en-1-yl]methanol
PubChem CID101050160
Molecular FormulaC14H24O
Molecular Weight208.34 g/mol
Exact Mass208.18
IUPAC Name(S)-cyclohexyl-[(1R,5R)-5-methylcyclohex-2-en-1-yl]methanol
SMILESC[C@@H]1CC=C[C@H]([C@@H](O)C2CCCCC2)C1
InChIInChI=1S/C14H24O/c1-11-6-5-9-13(10-11)14(15)12-7-3-2-4-8-12/h5,9,11-15H,2-4,6-8,10H2,1H3/t11-,13+,14+/m1/s1
InChIKeyHHXGPLRQKQVDKY-XBFCOCLRSA-N
XLogP3.53
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.34
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze (S)-cyclohexyl-[(1R,5R)-5-methylcyclohex-2-en-1-yl]methanol 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

(R)-[(1S,5R)-5-methylcyclohex-2-en-1-yl]-phenylmethanol
CID 10608189
cyclooctyl(cyclopropyl)methanol
CID 80603317
1-cyclohexyl-2-cyclopentylethane-1,2-diol
CID 103459295
(3,5-dimethylcyclohexyl)-(2-methylcyclopentyl)methanol
CID 107192400
(R)-cyclohexyl-[(1R)-2,2-dimethylcyclopropyl]methanol
CID 101342425
(3R,5R)-3-bromo-5-methylcyclohexene
CID 5325852
cyclohexyl-[7-[(1R,2R)-2-fluorocyclopropyl]-7,8-dihydroimidazo[1,5-a]pyridin-8-yl]methanol
CID 145166894
(1S)-1-[(1S,2Z)-cyclonon-2-en-1-yl]propan-1-ol
CID 11030459
cycloheptyl-(3-methyloxolan-2-yl)methanol
CID 115829556
1-cyclopentylethylcyclohexane
CID 57034702
zinc;azanide;1,3-dicyclohexylpropane-1,3-diol;4-methylpiperidin-1-ide;dihydrate
CID 5252570
cyclooctyl-(4-ethylcyclohexyl)methanol
CID 80602985

Frequently Asked Questions

What is the IUPAC name of (S)-cyclohexyl-[(1R,5R)-5-methylcyclohex-2-en-1-yl]methanol?
The IUPAC name of (S)-cyclohexyl-[(1R,5R)-5-methylcyclohex-2-en-1-yl]methanol (CID 101050160) is (S)-cyclohexyl-[(1R,5R)-5-methylcyclohex-2-en-1-yl]methanol.
What is the SMILES notation for (S)-cyclohexyl-[(1R,5R)-5-methylcyclohex-2-en-1-yl]methanol?
The canonical SMILES for (S)-cyclohexyl-[(1R,5R)-5-methylcyclohex-2-en-1-yl]methanol is C[C@@H]1CC=C[C@H]([C@@H](O)C2CCCCC2)C1.
What is the InChIKey of (S)-cyclohexyl-[(1R,5R)-5-methylcyclohex-2-en-1-yl]methanol?
The InChIKey is HHXGPLRQKQVDKY-XBFCOCLRSA-N. The full InChI is InChI=1S/C14H24O/c1-11-6-5-9-13(10-11)14(15)12-7-3-2-4-8-12/h5,9,11-15H,2-4,6-8,10H2,1H3/t11-,13+,14+/m1/s1.
What are the key properties of (S)-cyclohexyl-[(1R,5R)-5-methylcyclohex-2-en-1-yl]methanol?
(S)-cyclohexyl-[(1R,5R)-5-methylcyclohex-2-en-1-yl]methanol has a molecular weight of 208.34 g/mol, XLogP of 3.53, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (S)-cyclohexyl-[(1R,5R)-5-methylcyclohex-2-en-1-yl]methanol is sourced from PubChem (CID 101050160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).