4-methylidene-3-propan-2-ylhept-1-ene

C11H20 — CID 123221748

IUPAC4-methylidene-3-propan-2-ylhept-1-ene
SMILESC=CC(C(=C)CCC)C(C)C
InChIInChI=1S/C11H20/c1-6-8-10(5)11(7-2)9(3)4/h7,9,11H,2,5-6,8H2,1,3-4H3
InChIKeyHMKMKMLZSWBMJT-UHFFFAOYSA-N
MW152.28 g/mol
LogP3.80
Rot. Bonds5

About 4-methylidene-3-propan-2-ylhept-1-ene

4-methylidene-3-propan-2-ylhept-1-ene (PubChem CID 123221748) has the molecular formula C11H20 and a molecular weight of 152.28 g/mol. Its IUPAC name is 4-methylidene-3-propan-2-ylhept-1-ene.

Molecular Properties

Compound Name4-methylidene-3-propan-2-ylhept-1-ene
PubChem CID123221748
Molecular FormulaC11H20
Molecular Weight152.28 g/mol
Exact Mass152.16
IUPAC Name4-methylidene-3-propan-2-ylhept-1-ene
SMILESC=CC(C(=C)CCC)C(C)C
InChIInChI=1S/C11H20/c1-6-8-10(5)11(7-2)9(3)4/h7,9,11H,2,5-6,8H2,1,3-4H3
InChIKeyHMKMKMLZSWBMJT-UHFFFAOYSA-N
XLogP3.80
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.28
LogP ≤ 53.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 4-methylidene-3-propan-2-ylhept-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

4,5-Dimethyl-1-hexene
CID 27683
3,4-Dimethyl-1-hexene
CID 140134
1-Heptene, 5-methyl-
CID 99888
p-Menth-1-ene
CID 21671
2,4-Dimethyl-1-heptene
CID 123385
Neophytadiene
CID 10446
(+)-p-Menth-1-ene
CID 70954
3,7-Dimethyloct-1-ene
CID 21085
trans-Isolimonene
CID 22831540
(3R-trans)-3-Methyl-6-(1-methylvinyl)cyclohexene
CID 78790
10-Methyl-1-undecene
CID 519941
3,4,5-Trimethyl-1-hexene
CID 41976

Frequently Asked Questions

What is the IUPAC name of 4-methylidene-3-propan-2-ylhept-1-ene?
The IUPAC name of 4-methylidene-3-propan-2-ylhept-1-ene (CID 123221748) is 4-methylidene-3-propan-2-ylhept-1-ene.
What is the SMILES notation for 4-methylidene-3-propan-2-ylhept-1-ene?
The canonical SMILES for 4-methylidene-3-propan-2-ylhept-1-ene is C=CC(C(=C)CCC)C(C)C.
What is the InChIKey of 4-methylidene-3-propan-2-ylhept-1-ene?
The InChIKey is HMKMKMLZSWBMJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20/c1-6-8-10(5)11(7-2)9(3)4/h7,9,11H,2,5-6,8H2,1,3-4H3.
What are the key properties of 4-methylidene-3-propan-2-ylhept-1-ene?
4-methylidene-3-propan-2-ylhept-1-ene has a molecular weight of 152.28 g/mol, XLogP of 3.80, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methylidene-3-propan-2-ylhept-1-ene is sourced from PubChem (CID 123221748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).