1-hept-6-enyl-2-methylcyclopropane

C11H20 — CID 173435443

IUPAC1-hept-6-enyl-2-methylcyclopropane
SMILESC=CCCCCCC1CC1C
InChIInChI=1S/C11H20/c1-3-4-5-6-7-8-11-9-10(11)2/h3,10-11H,1,4-9H2,2H3
InChIKeyWPZQSLSGNYTXMD-UHFFFAOYSA-N
MW152.28 g/mol
LogP3.78
Rot. Bonds6

About 1-hept-6-enyl-2-methylcyclopropane

1-hept-6-enyl-2-methylcyclopropane (PubChem CID 173435443) has the molecular formula C11H20 and a molecular weight of 152.28 g/mol. Its IUPAC name is 1-hept-6-enyl-2-methylcyclopropane.

Molecular Properties

Compound Name1-hept-6-enyl-2-methylcyclopropane
PubChem CID173435443
Molecular FormulaC11H20
Molecular Weight152.28 g/mol
Exact Mass152.16
IUPAC Name1-hept-6-enyl-2-methylcyclopropane
SMILESC=CCCCCCC1CC1C
InChIInChI=1S/C11H20/c1-3-4-5-6-7-8-11-9-10(11)2/h3,10-11H,1,4-9H2,2H3
InChIKeyWPZQSLSGNYTXMD-UHFFFAOYSA-N
XLogP3.78
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.28
LogP ≤ 53.78
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'}

Analyze 1-hept-6-enyl-2-methylcyclopropane 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

1-decyl-2-hexylcyclopropane;dodec-1-ene;hexadecane
CID 91501691
trans-(1S,2R)-1-deuterio-2-non-8-enyl-1-(8,8,8-trideuteriooctyl)cyclopropane
CID 138967812
1-methyl-2-pentadecylcyclopropane
CID 54385825
2-non-8-enyloxirane
CID 86075301
2-oct-7-enyloxirane
CID 160591597
1-ethenyl-2-octylcyclobutane;tetradec-1-ene
CID 173458281
(2-hept-6-enylcyclohexyl)methanamine
CID 107010667
heptacosa-1,26-diene
CID 58905535
heptadeca-1,16-diene
CID 6429392
N-ethyl-3-hept-6-enyl-2-methylcyclopentan-1-amine
CID 107010507
1-methyl-2-[6-(2-tetradecylcyclopropyl)hexyl]cyclopropane
CID 123959869
hex-5-enylcyclopentane
CID 20565123

Frequently Asked Questions

What is the IUPAC name of 1-hept-6-enyl-2-methylcyclopropane?
The IUPAC name of 1-hept-6-enyl-2-methylcyclopropane (CID 173435443) is 1-hept-6-enyl-2-methylcyclopropane.
What is the SMILES notation for 1-hept-6-enyl-2-methylcyclopropane?
The canonical SMILES for 1-hept-6-enyl-2-methylcyclopropane is C=CCCCCCC1CC1C.
What is the InChIKey of 1-hept-6-enyl-2-methylcyclopropane?
The InChIKey is WPZQSLSGNYTXMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20/c1-3-4-5-6-7-8-11-9-10(11)2/h3,10-11H,1,4-9H2,2H3.
What are the key properties of 1-hept-6-enyl-2-methylcyclopropane?
1-hept-6-enyl-2-methylcyclopropane has a molecular weight of 152.28 g/mol, XLogP of 3.78, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hept-6-enyl-2-methylcyclopropane is sourced from PubChem (CID 173435443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).