5-methyl-9-methylidenetetradecane

C16H32 — CID 142037910

IUPAC5-methyl-9-methylidenetetradecane
SMILESC=C(CCCCC)CCCC(C)CCCC
InChIInChI=1S/C16H32/c1-5-7-9-12-16(4)14-10-13-15(3)11-8-6-2/h15H,4-14H2,1-3H3
InChIKeyOQXYPQKSYZXVOF-UHFFFAOYSA-N
MW224.43 g/mol
LogP6.12
Rot. Bonds11

About 5-methyl-9-methylidenetetradecane

5-methyl-9-methylidenetetradecane (PubChem CID 142037910) has the molecular formula C16H32 and a molecular weight of 224.43 g/mol. Its IUPAC name is 5-methyl-9-methylidenetetradecane.

Molecular Properties

Compound Name5-methyl-9-methylidenetetradecane
PubChem CID142037910
Molecular FormulaC16H32
Molecular Weight224.43 g/mol
Exact Mass224.25
IUPAC Name5-methyl-9-methylidenetetradecane
SMILESC=C(CCCCC)CCCC(C)CCCC
InChIInChI=1S/C16H32/c1-5-7-9-12-16(4)14-10-13-15(3)11-8-6-2/h15H,4-14H2,1-3H3
InChIKeyOQXYPQKSYZXVOF-UHFFFAOYSA-N
XLogP6.12
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds11
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500224.43
LogP ≤ 56.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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

4-methyl-8-methylidenedodecane
CID 123605795
3,5-dimethyl-10-methylidenepentadecane
CID 123460821
2-chloro-6-methylidenedodecane
CID 139337956
(3S)-3-methyl-6-methylidenehenicosane
CID 174024311
ethene;9-methylheptadecane;N-methyl-8-methylidene-N-octyloctadecan-1-amine
CID 142431893
9,10-dimethyl-5-methylidenepentadecane
CID 142544689
2-methyl-5-methylideneundecane
CID 54320712
6-methylidenedodecane
CID 21453027
6-methylidenetetradecane
CID 21477883
2,11-dimethylnonadec-1-ene
CID 123484198
19-methylideneheptatriacontane;titanium
CID 174477367
17-methylidenetricosan-9-amine
CID 129036120

Frequently Asked Questions

What is the IUPAC name of 5-methyl-9-methylidenetetradecane?
The IUPAC name of 5-methyl-9-methylidenetetradecane (CID 142037910) is 5-methyl-9-methylidenetetradecane.
What is the SMILES notation for 5-methyl-9-methylidenetetradecane?
The canonical SMILES for 5-methyl-9-methylidenetetradecane is C=C(CCCCC)CCCC(C)CCCC.
What is the InChIKey of 5-methyl-9-methylidenetetradecane?
The InChIKey is OQXYPQKSYZXVOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32/c1-5-7-9-12-16(4)14-10-13-15(3)11-8-6-2/h15H,4-14H2,1-3H3.
What are the key properties of 5-methyl-9-methylidenetetradecane?
5-methyl-9-methylidenetetradecane has a molecular weight of 224.43 g/mol, XLogP of 6.12, 11 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-9-methylidenetetradecane is sourced from PubChem (CID 142037910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).