5-methylbicyclo[4.2.1]non-1-en-7-ol

C10H16O — CID 163789107

IUPAC5-methylbicyclo[4.2.1]non-1-en-7-ol
SMILESCC1CCC=C2CC(O)C1C2
InChIInChI=1S/C10H16O/c1-7-3-2-4-8-5-9(7)10(11)6-8/h4,7,9-11H,2-3,5-6H2,1H3
InChIKeyMVDJKKYCDGHJLW-UHFFFAOYSA-N
MW152.24 g/mol
LogP2.11
Rot. Bonds

About 5-methylbicyclo[4.2.1]non-1-en-7-ol

5-methylbicyclo[4.2.1]non-1-en-7-ol (PubChem CID 163789107) has the molecular formula C10H16O and a molecular weight of 152.24 g/mol. Its IUPAC name is 5-methylbicyclo[4.2.1]non-1-en-7-ol.

Molecular Properties

Compound Name5-methylbicyclo[4.2.1]non-1-en-7-ol
PubChem CID163789107
Molecular FormulaC10H16O
Molecular Weight152.24 g/mol
Exact Mass152.12
IUPAC Name5-methylbicyclo[4.2.1]non-1-en-7-ol
SMILESCC1CCC=C2CC(O)C1C2
InChIInChI=1S/C10H16O/c1-7-3-2-4-8-5-9(7)10(11)6-8/h4,7,9-11H,2-3,5-6H2,1H3
InChIKeyMVDJKKYCDGHJLW-UHFFFAOYSA-N
XLogP2.11
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 52.11
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

5-methylbicyclo[4.1.0]hept-1-ene
CID 123971358
(4Z)-4,8-dimethylcyclooct-4-ene-1,2-diol
CID 23092826
(1S,6S)-2-chloro-6-methylcyclohex-2-en-1-ol
CID 58637363
1,5-dimethylcyclohexene
CID 520362
6-cyclopentyl-N,N,5-trimethylcycloheptene-1-carboxamide
CID 123767669
1-[(1R,3S,8R,9S,11R)-4,8,11-trimethyl-3-bicyclo[7.2.0]undec-4-enyl]ethanone
CID 3085436
(5S)-5-methylcyclohexen-1-amine
CID 163541060
(1R)-3-methylcyclohex-3-en-1-ol
CID 144556307
5-methylcyclooct-5-ene-1,2-diol
CID 68741308
2,6-dimethylcyclohex-2-ene-1-carboxylic acid
CID 45084784
2-cyclobutyl-6-methylcyclohex-2-en-1-amine
CID 66604382
(1R,8R,9R)-4,8,11,11-tetramethylbicyclo[7.2.0]undec-4-ene
CID 91099297

Frequently Asked Questions

What is the IUPAC name of 5-methylbicyclo[4.2.1]non-1-en-7-ol?
The IUPAC name of 5-methylbicyclo[4.2.1]non-1-en-7-ol (CID 163789107) is 5-methylbicyclo[4.2.1]non-1-en-7-ol.
What is the SMILES notation for 5-methylbicyclo[4.2.1]non-1-en-7-ol?
The canonical SMILES for 5-methylbicyclo[4.2.1]non-1-en-7-ol is CC1CCC=C2CC(O)C1C2.
What is the InChIKey of 5-methylbicyclo[4.2.1]non-1-en-7-ol?
The InChIKey is MVDJKKYCDGHJLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O/c1-7-3-2-4-8-5-9(7)10(11)6-8/h4,7,9-11H,2-3,5-6H2,1H3.
What are the key properties of 5-methylbicyclo[4.2.1]non-1-en-7-ol?
5-methylbicyclo[4.2.1]non-1-en-7-ol has a molecular weight of 152.24 g/mol, XLogP of 2.11, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methylbicyclo[4.2.1]non-1-en-7-ol is sourced from PubChem (CID 163789107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).