14-methylpentadec-1-en-1-ol

C16H32O — CID 87787742

IUPAC14-methylpentadec-1-en-1-ol
SMILESCC(C)CCCCCCCCCCCC=CO
InChIInChI=1S/C16H32O/c1-16(2)14-12-10-8-6-4-3-5-7-9-11-13-15-17/h13,15-17H,3-12,14H2,1-2H3
InChIKeyNQYMHUSQUIKMMR-UHFFFAOYSA-N
MW240.43 g/mol
LogP6.01
Rot. Bonds12

About 14-methylpentadec-1-en-1-ol

14-methylpentadec-1-en-1-ol (PubChem CID 87787742) has the molecular formula C16H32O and a molecular weight of 240.43 g/mol. Its IUPAC name is 14-methylpentadec-1-en-1-ol.

Molecular Properties

Compound Name14-methylpentadec-1-en-1-ol
PubChem CID87787742
Molecular FormulaC16H32O
Molecular Weight240.43 g/mol
Exact Mass240.25
IUPAC Name14-methylpentadec-1-en-1-ol
SMILESCC(C)CCCCCCCCCCCC=CO
InChIInChI=1S/C16H32O/c1-16(2)14-12-10-8-6-4-3-5-7-9-11-13-15-17/h13,15-17H,3-12,14H2,1-2H3
InChIKeyNQYMHUSQUIKMMR-UHFFFAOYSA-N
XLogP6.01
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds12
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500240.43
LogP ≤ 56.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

(E)-2,15-dimethylhexadec-8-ene
CID 176630932
(Z)-2,15-dimethylhexadec-8-ene
CID 176630952
(Z)-2,16-dimethylheptadec-6-ene
CID 176630987
(E)-2,16-dimethylheptadec-6-ene
CID 176630989
(Z)-2,11-dimethyldodec-6-ene;(E)-2,11-dimethyldodec-6-ene;(Z)-2,14-dimethylpentadec-6-ene;(E)-2,14-dimethylpentadec-6-ene
CID 161032897
(E)-2,13-dimethyltetradec-7-ene
CID 176630990
(E)-2,12-dimethyltridec-6-ene
CID 176630963
7-methylpentadec-1-en-1-ol
CID 73444585
(E)-7-methylpentadec-1-en-1-ol
CID 18427313
(E)-11-methyldodec-2-ene
CID 134687647
(E)-2,11-dimethyldodec-5-ene
CID 168834978
(Z)-8-methylnon-2-en-1-ol
CID 14353387

Frequently Asked Questions

What is the IUPAC name of 14-methylpentadec-1-en-1-ol?
The IUPAC name of 14-methylpentadec-1-en-1-ol (CID 87787742) is 14-methylpentadec-1-en-1-ol.
What is the SMILES notation for 14-methylpentadec-1-en-1-ol?
The canonical SMILES for 14-methylpentadec-1-en-1-ol is CC(C)CCCCCCCCCCCC=CO.
What is the InChIKey of 14-methylpentadec-1-en-1-ol?
The InChIKey is NQYMHUSQUIKMMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32O/c1-16(2)14-12-10-8-6-4-3-5-7-9-11-13-15-17/h13,15-17H,3-12,14H2,1-2H3.
What are the key properties of 14-methylpentadec-1-en-1-ol?
14-methylpentadec-1-en-1-ol has a molecular weight of 240.43 g/mol, XLogP of 6.01, 12 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 14-methylpentadec-1-en-1-ol is sourced from PubChem (CID 87787742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).