10,10-dimethyl-9-methylideneundec-5-yne

C14H24 — CID 10607796

IUPAC10,10-dimethyl-9-methylideneundec-5-yne
SMILESC=C(CCC#CCCCC)C(C)(C)C
InChIInChI=1S/C14H24/c1-6-7-8-9-10-11-12-13(2)14(3,4)5/h2,6-8,11-12H2,1,3-5H3
InChIKeyQPBRLUYXOXBZPA-UHFFFAOYSA-N
MW192.35 g/mol
LogP4.56
Rot. Bonds4

About 10,10-dimethyl-9-methylideneundec-5-yne

10,10-dimethyl-9-methylideneundec-5-yne (PubChem CID 10607796) has the molecular formula C14H24 and a molecular weight of 192.35 g/mol. Its IUPAC name is 10,10-dimethyl-9-methylideneundec-5-yne.

Molecular Properties

Compound Name10,10-dimethyl-9-methylideneundec-5-yne
PubChem CID10607796
Molecular FormulaC14H24
Molecular Weight192.35 g/mol
Exact Mass192.19
IUPAC Name10,10-dimethyl-9-methylideneundec-5-yne
SMILESC=C(CCC#CCCCC)C(C)(C)C
InChIInChI=1S/C14H24/c1-6-7-8-9-10-11-12-13(2)14(3,4)5/h2,6-8,11-12H2,1,3-5H3
InChIKeyQPBRLUYXOXBZPA-UHFFFAOYSA-N
XLogP4.56
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.35
LogP ≤ 54.56
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'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

2,4,4-Trimethyl-1-pentene
CID 7868
2,4,4-Trimethyl-1-hexene
CID 142817
2,3,3-Trimethyl-1-hexene
CID 530395
2,5,5-Trimethyl-1-hexene
CID 545898
2,2-Dimethyl-4-methylidenehexane
CID 20297399
7-Methylene-undec-5-yne
CID 10866683
CID 91001281
CID 91001281
5-Methylidenedodec-6-yne
CID 134978424
2,8-Dimethyl-6-methylidenenon-4-yne
CID 134980913
CID 135081444
CID 135081444
2-Methyl-3-(2,2-dimethylpropyl)-butadiene
CID 545358
9-Ethynyl-6,9-dimethyltetradeca-1,6,7,13-tetraene
CID 71396039

Frequently Asked Questions

What is the IUPAC name of 10,10-dimethyl-9-methylideneundec-5-yne?
The IUPAC name of 10,10-dimethyl-9-methylideneundec-5-yne (CID 10607796) is 10,10-dimethyl-9-methylideneundec-5-yne.
What is the SMILES notation for 10,10-dimethyl-9-methylideneundec-5-yne?
The canonical SMILES for 10,10-dimethyl-9-methylideneundec-5-yne is C=C(CCC#CCCCC)C(C)(C)C.
What is the InChIKey of 10,10-dimethyl-9-methylideneundec-5-yne?
The InChIKey is QPBRLUYXOXBZPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24/c1-6-7-8-9-10-11-12-13(2)14(3,4)5/h2,6-8,11-12H2,1,3-5H3.
What are the key properties of 10,10-dimethyl-9-methylideneundec-5-yne?
10,10-dimethyl-9-methylideneundec-5-yne has a molecular weight of 192.35 g/mol, XLogP of 4.56, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 10,10-dimethyl-9-methylideneundec-5-yne is sourced from PubChem (CID 10607796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).