2-methyl-5-(2-methyl-3-methylidene-2-bicyclo[2.2.1]heptanyl)pent-1-en-3-ol

C15H24O — CID 54129686

IUPAC2-methyl-5-(2-methyl-3-methylidene-2-bicyclo[2.2.1]heptanyl)pent-1-en-3-ol
SMILESC=C(C)C(O)CCC1(C)C(=C)C2CCC1C2
InChIInChI=1S/C15H24O/c1-10(2)14(16)7-8-15(4)11(3)12-5-6-13(15)9-12/h12-14,16H,1,3,5-9H2,2,4H3
InChIKeyNTLZMJLQRHPWMB-UHFFFAOYSA-N
MW220.36 g/mol
LogP3.70
Rot. Bonds4

About 2-methyl-5-(2-methyl-3-methylidene-2-bicyclo[2.2.1]heptanyl)pent-1-en-3-ol

2-methyl-5-(2-methyl-3-methylidene-2-bicyclo[2.2.1]heptanyl)pent-1-en-3-ol (PubChem CID 54129686) has the molecular formula C15H24O and a molecular weight of 220.36 g/mol. Its IUPAC name is 2-methyl-5-(2-methyl-3-methylidene-2-bicyclo[2.2.1]heptanyl)pent-1-en-3-ol.

Molecular Properties

Compound Name2-methyl-5-(2-methyl-3-methylidene-2-bicyclo[2.2.1]heptanyl)pent-1-en-3-ol
PubChem CID54129686
Molecular FormulaC15H24O
Molecular Weight220.36 g/mol
Exact Mass220.18
IUPAC Name2-methyl-5-(2-methyl-3-methylidene-2-bicyclo[2.2.1]heptanyl)pent-1-en-3-ol
SMILESC=C(C)C(O)CCC1(C)C(=C)C2CCC1C2
InChIInChI=1S/C15H24O/c1-10(2)14(16)7-8-15(4)11(3)12-5-6-13(15)9-12/h12-14,16H,1,3,5-9H2,2,4H3
InChIKeyNTLZMJLQRHPWMB-UHFFFAOYSA-N
XLogP3.70
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 53.70
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

(1S)-2-methyl-3-methylidene-2-(4-methylpent-3-enyl)bicyclo[2.2.1]heptane
CID 90472923
2-methyl-5-[(2R)-2-methyl-3-methylidene-2-bicyclo[2.2.1]heptanyl]pent-2-en-1-ol
CID 123863985
2-methyl-5-[(2R,4R)-2-methyl-3-methylidene-2-bicyclo[2.2.1]heptanyl]pent-2-en-1-ol
CID 54154316
(Z)-2-methyl-5-[(1S,2R,4R)-2-methyl-3-methylidene-2-bicyclo[2.2.1]heptanyl]pent-2-en-1-ol
CID 6857681
(Z)-2-methyl-5-[(1R,2S,4S)-2-methyl-3-methylidene-2-bicyclo[2.2.1]heptanyl]pent-2-en-1-ol
CID 118978202
(1S,2R,4R)-2-methyl-3-methylidene-2-(2-methylpropyl)bicyclo[2.2.1]heptane
CID 158630682
(1S,2S,4S,7R)-7-[(3S)-3-hydroxy-4-methylpent-4-enyl]-1,7-dimethylbicyclo[2.2.1]heptan-2-ol
CID 162886605
5-(2,3-dimethyl-3-tricyclo[2.2.1.02,6]heptanyl)-2-methylpent-2-en-1-ol;(Z)-2-methyl-5-[(1S,4R)-2-methyl-3-methylidene-2-bicyclo[2.2.1]heptanyl]pent-2-en-1-ol
CID 159532023
2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptane;methanol
CID 19065853
(Z)-5-[(1S,3R)-2,3-dimethyl-3-tricyclo[2.2.1.02,6]heptanyl]-2-methylpent-2-en-1-ol;(1S,2R,4R)-2-methyl-2-[(Z)-4-methylhex-3-enyl]-3-methylidenebicyclo[2.2.1]heptane
CID 160916467
[(1E,3E)-2-methyl-5-[(1S,2R,4R)-2-methyl-3-methylidene-2-bicyclo[2.2.1]heptanyl]penta-1,3-dienyl] acetate
CID 52951412
(1S,2S,4S)-2-ethynyl-3-methylidenebicyclo[2.2.1]heptan-2-ol
CID 129389246

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-(2-methyl-3-methylidene-2-bicyclo[2.2.1]heptanyl)pent-1-en-3-ol?
The IUPAC name of 2-methyl-5-(2-methyl-3-methylidene-2-bicyclo[2.2.1]heptanyl)pent-1-en-3-ol (CID 54129686) is 2-methyl-5-(2-methyl-3-methylidene-2-bicyclo[2.2.1]heptanyl)pent-1-en-3-ol.
What is the SMILES notation for 2-methyl-5-(2-methyl-3-methylidene-2-bicyclo[2.2.1]heptanyl)pent-1-en-3-ol?
The canonical SMILES for 2-methyl-5-(2-methyl-3-methylidene-2-bicyclo[2.2.1]heptanyl)pent-1-en-3-ol is C=C(C)C(O)CCC1(C)C(=C)C2CCC1C2.
What is the InChIKey of 2-methyl-5-(2-methyl-3-methylidene-2-bicyclo[2.2.1]heptanyl)pent-1-en-3-ol?
The InChIKey is NTLZMJLQRHPWMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24O/c1-10(2)14(16)7-8-15(4)11(3)12-5-6-13(15)9-12/h12-14,16H,1,3,5-9H2,2,4H3.
What are the key properties of 2-methyl-5-(2-methyl-3-methylidene-2-bicyclo[2.2.1]heptanyl)pent-1-en-3-ol?
2-methyl-5-(2-methyl-3-methylidene-2-bicyclo[2.2.1]heptanyl)pent-1-en-3-ol has a molecular weight of 220.36 g/mol, XLogP of 3.70, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-(2-methyl-3-methylidene-2-bicyclo[2.2.1]heptanyl)pent-1-en-3-ol is sourced from PubChem (CID 54129686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).