3-methyltetradec-5-en-1-ol

C15H30O — CID 141478890

IUPAC3-methyltetradec-5-en-1-ol
SMILESCCCCCCCCC=CCC(C)CCO
InChIInChI=1S/C15H30O/c1-3-4-5-6-7-8-9-10-11-12-15(2)13-14-16/h10-11,15-16H,3-9,12-14H2,1-2H3
InChIKeyJGFMYONJJUXFJS-UHFFFAOYSA-N
MW226.40 g/mol
LogP4.70
Rot. Bonds11

About 3-methyltetradec-5-en-1-ol

3-methyltetradec-5-en-1-ol (PubChem CID 141478890) has the molecular formula C15H30O and a molecular weight of 226.40 g/mol. Its IUPAC name is 3-methyltetradec-5-en-1-ol.

Molecular Properties

Compound Name3-methyltetradec-5-en-1-ol
PubChem CID141478890
Molecular FormulaC15H30O
Molecular Weight226.40 g/mol
Exact Mass226.23
IUPAC Name3-methyltetradec-5-en-1-ol
SMILESCCCCCCCCC=CCC(C)CCO
InChIInChI=1S/C15H30O/c1-3-4-5-6-7-8-9-10-11-12-15(2)13-14-16/h10-11,15-16H,3-9,12-14H2,1-2H3
InChIKeyJGFMYONJJUXFJS-UHFFFAOYSA-N
XLogP4.70
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.40
LogP ≤ 54.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(E)-10-methyloctadec-7-ene
CID 173194246
(E)-5-methyltetradec-7-ene
CID 173194503
9,16-dimethyltetracos-11-ene
CID 123705440
8-methyltridec-5-ene
CID 123857568
(E)-3-methylnonadec-5-ene
CID 145095642
(Z)-18-ethyl-9,27,29-trimethyltetratriacont-6-ene
CID 174139015
(Z)-9-methylheptadec-6-enoic acid
CID 52921788
16-methyl-2-octadecyldocos-13-enoic acid
CID 174214728
13-methyl-2-tetradecyltetracos-15-enoic acid
CID 174214891
5-methyltridec-2-en-1-ol
CID 139697199
3-octadec-9-enylpentane-1,5-diol
CID 91381537
(E)-dodec-4-en-2-amine
CID 55254669

Frequently Asked Questions

What is the IUPAC name of 3-methyltetradec-5-en-1-ol?
The IUPAC name of 3-methyltetradec-5-en-1-ol (CID 141478890) is 3-methyltetradec-5-en-1-ol.
What is the SMILES notation for 3-methyltetradec-5-en-1-ol?
The canonical SMILES for 3-methyltetradec-5-en-1-ol is CCCCCCCCC=CCC(C)CCO.
What is the InChIKey of 3-methyltetradec-5-en-1-ol?
The InChIKey is JGFMYONJJUXFJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30O/c1-3-4-5-6-7-8-9-10-11-12-15(2)13-14-16/h10-11,15-16H,3-9,12-14H2,1-2H3.
What are the key properties of 3-methyltetradec-5-en-1-ol?
3-methyltetradec-5-en-1-ol has a molecular weight of 226.40 g/mol, XLogP of 4.70, 11 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyltetradec-5-en-1-ol is sourced from PubChem (CID 141478890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).