cis-(1R,3R)-1-methyl-3-prop-1-en-2-ylcyclohexan-1-ol

C10H18O — CID 162915511

IUPACcis-(1R,3R)-1-methyl-3-prop-1-en-2-ylcyclohexan-1-ol
SMILESC=C(C)[C@@H]1CCC[C@@](C)(O)C1
InChIInChI=1S/C10H18O/c1-8(2)9-5-4-6-10(3,11)7-9/h9,11H,1,4-7H2,2-3H3/t9-,10-/m1/s1
InChIKeyVGPLDSHNPDDKNO-NXEZZACHSA-N
MW154.25 g/mol
LogP2.50
Rot. Bonds1

About cis-(1R,3R)-1-methyl-3-prop-1-en-2-ylcyclohexan-1-ol

cis-(1R,3R)-1-methyl-3-prop-1-en-2-ylcyclohexan-1-ol (PubChem CID 162915511) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is cis-(1R,3R)-1-methyl-3-prop-1-en-2-ylcyclohexan-1-ol.

Molecular Properties

Compound Namecis-(1R,3R)-1-methyl-3-prop-1-en-2-ylcyclohexan-1-ol
PubChem CID162915511
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Namecis-(1R,3R)-1-methyl-3-prop-1-en-2-ylcyclohexan-1-ol
SMILESC=C(C)[C@@H]1CCC[C@@](C)(O)C1
InChIInChI=1S/C10H18O/c1-8(2)9-5-4-6-10(3,11)7-9/h9,11H,1,4-7H2,2-3H3/t9-,10-/m1/s1
InChIKeyVGPLDSHNPDDKNO-NXEZZACHSA-N
XLogP2.50
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.25
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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CID 176717256
(3S,4aS,8aR)-8a-methyl-5-methylidene-3-prop-1-en-2-yl-2,3,4,6,7,8-hexahydro-1H-naphthalen-4a-ol
CID 163013816
(1S,4R,4aR,6R,8aS)-4,8a-dimethyl-6-prop-1-en-2-yl-1,2,3,4,5,6,7,8-octahydronaphthalene-1,4a-diol
CID 162963435
3-bromo-1-methyl-4-prop-1-en-2-ylcyclohexan-1-ol
CID 175178027
3-prop-1-en-2-yltricyclo[4.1.1.01,6]octane
CID 163960686
3-tert-butyl-1-methylcyclohexan-1-ol
CID 58395164
(1S,3R,5R,8S,10R,12R)-5,12-bis(prop-1-en-2-yl)-2,9-dioxatetracyclo[6.6.2.01,10.03,8]hexadecane-3,10-diol
CID 139091680
N-(3-hydroxy-3-methylcyclohexyl)acetamide
CID 139373491
N-[(1R,3R)-3-hydroxy-3-methylcyclohexyl]acetamide
CID 162469361
1-methyl-4-prop-1-en-2-ylcyclohexan-1-amine
CID 155018164
(1S,2R,4S)-1-methyl-4-prop-1-en-2-ylcyclohexane-1,2-diol
CID 86310295
(1S,2R,5R)-1-ethyl-2-methyl-5-prop-1-en-2-ylcyclohexan-1-ol
CID 10397451

Frequently Asked Questions

What is the IUPAC name of cis-(1R,3R)-1-methyl-3-prop-1-en-2-ylcyclohexan-1-ol?
The IUPAC name of cis-(1R,3R)-1-methyl-3-prop-1-en-2-ylcyclohexan-1-ol (CID 162915511) is cis-(1R,3R)-1-methyl-3-prop-1-en-2-ylcyclohexan-1-ol.
What is the SMILES notation for cis-(1R,3R)-1-methyl-3-prop-1-en-2-ylcyclohexan-1-ol?
The canonical SMILES for cis-(1R,3R)-1-methyl-3-prop-1-en-2-ylcyclohexan-1-ol is C=C(C)[C@@H]1CCC[C@@](C)(O)C1.
What is the InChIKey of cis-(1R,3R)-1-methyl-3-prop-1-en-2-ylcyclohexan-1-ol?
The InChIKey is VGPLDSHNPDDKNO-NXEZZACHSA-N. The full InChI is InChI=1S/C10H18O/c1-8(2)9-5-4-6-10(3,11)7-9/h9,11H,1,4-7H2,2-3H3/t9-,10-/m1/s1.
What are the key properties of cis-(1R,3R)-1-methyl-3-prop-1-en-2-ylcyclohexan-1-ol?
cis-(1R,3R)-1-methyl-3-prop-1-en-2-ylcyclohexan-1-ol has a molecular weight of 154.25 g/mol, XLogP of 2.50, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,3R)-1-methyl-3-prop-1-en-2-ylcyclohexan-1-ol is sourced from PubChem (CID 162915511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).