2-methyl-4-methylidenehept-1-ene

C9H16 — CID 58948030

IUPAC2-methyl-4-methylidenehept-1-ene
SMILESC=C(C)CC(=C)CCC
InChIInChI=1S/C9H16/c1-5-6-9(4)7-8(2)3/h2,4-7H2,1,3H3
InChIKeyGXALGZHRCRSIEU-UHFFFAOYSA-N
MW124.23 g/mol
LogP3.31
Rot. Bonds4

About 2-methyl-4-methylidenehept-1-ene

2-methyl-4-methylidenehept-1-ene (PubChem CID 58948030) has the molecular formula C9H16 and a molecular weight of 124.23 g/mol. Its IUPAC name is 2-methyl-4-methylidenehept-1-ene.

Molecular Properties

Compound Name2-methyl-4-methylidenehept-1-ene
PubChem CID58948030
Molecular FormulaC9H16
Molecular Weight124.23 g/mol
Exact Mass124.13
IUPAC Name2-methyl-4-methylidenehept-1-ene
SMILESC=C(C)CC(=C)CCC
InChIInChI=1S/C9H16/c1-5-6-9(4)7-8(2)3/h2,4-7H2,1,3H3
InChIKeyGXALGZHRCRSIEU-UHFFFAOYSA-N
XLogP3.31
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.23
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 2-methyl-4-methylidenehept-1-ene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4,7-dimethylidenedecane
CID 543440
3-methylidenehexanoic acid
CID 13159263
methane;hexakis(2-methylpent-1-ene)
CID 175346690
2-methyl-4-methylideneocta-1,7-diene
CID 140752999
2,4-dimethyl-6-methylidenenon-3-ene
CID 123168107
sodium;hydride;2-methylpent-1-ene
CID 174251970
1,1-difluoro-2-methyl-5-methylideneoct-1-ene
CID 58962882
4-methyl-7-methylidenedec-4-ene
CID 173283032
4,5-dimethylideneoctane
CID 13294231
methane;2-methylpent-1-ene;bis(prop-1-ene)
CID 159090973
4-methylidenenonadecane
CID 139983203
4-methylidenetricosane
CID 139983205

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-methylidenehept-1-ene?
The IUPAC name of 2-methyl-4-methylidenehept-1-ene (CID 58948030) is 2-methyl-4-methylidenehept-1-ene.
What is the SMILES notation for 2-methyl-4-methylidenehept-1-ene?
The canonical SMILES for 2-methyl-4-methylidenehept-1-ene is C=C(C)CC(=C)CCC.
What is the InChIKey of 2-methyl-4-methylidenehept-1-ene?
The InChIKey is GXALGZHRCRSIEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16/c1-5-6-9(4)7-8(2)3/h2,4-7H2,1,3H3.
What are the key properties of 2-methyl-4-methylidenehept-1-ene?
2-methyl-4-methylidenehept-1-ene has a molecular weight of 124.23 g/mol, XLogP of 3.31, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-methylidenehept-1-ene is sourced from PubChem (CID 58948030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).