1-butyl-3-propan-2-ylidenecyclobutene

C11H18 — CID 10261257

IUPAC1-butyl-3-propan-2-ylidenecyclobutene
SMILESCCCCC1=CC(=C(C)C)C1
InChIInChI=1S/C11H18/c1-4-5-6-10-7-11(8-10)9(2)3/h7H,4-6,8H2,1-3H3
InChIKeyAAPLPBVHRAUMCP-UHFFFAOYSA-N
MW150.26 g/mol
LogP3.84
Rot. Bonds3

About 1-butyl-3-propan-2-ylidenecyclobutene

1-butyl-3-propan-2-ylidenecyclobutene (PubChem CID 10261257) has the molecular formula C11H18 and a molecular weight of 150.26 g/mol. Its IUPAC name is 1-butyl-3-propan-2-ylidenecyclobutene.

Molecular Properties

Compound Name1-butyl-3-propan-2-ylidenecyclobutene
PubChem CID10261257
Molecular FormulaC11H18
Molecular Weight150.26 g/mol
Exact Mass150.14
IUPAC Name1-butyl-3-propan-2-ylidenecyclobutene
SMILESCCCCC1=CC(=C(C)C)C1
InChIInChI=1S/C11H18/c1-4-5-6-10-7-11(8-10)9(2)3/h7H,4-6,8H2,1-3H3
InChIKeyAAPLPBVHRAUMCP-UHFFFAOYSA-N
XLogP3.84
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.26
LogP ≤ 53.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 1-butyl-3-propan-2-ylidenecyclobutene 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-Propyl-3-heptene
CID 138270
p-Mentha-1,3,8-triene
CID 176983
(2Z)-3-Methyl-4-methylideneoct-2-ene
CID 121232770
Sylveterpinolene
CID 524200
2-Methyl-2-undecene
CID 549973
Cyclohexene, 1-pentyl-
CID 139915
4-Nonene, 5-butyl-
CID 300477
1-Methylcyclooctene
CID 5352545
Cyclopentene, 1-butyl-
CID 137594
(E,Z)-2,4-Dodecadiene
CID 5365771
3-Butyl-1-methylcyclopenta-1,3-diene
CID 11094679
7-Methyl-6-tridecene
CID 5364660

Frequently Asked Questions

What is the IUPAC name of 1-butyl-3-propan-2-ylidenecyclobutene?
The IUPAC name of 1-butyl-3-propan-2-ylidenecyclobutene (CID 10261257) is 1-butyl-3-propan-2-ylidenecyclobutene.
What is the SMILES notation for 1-butyl-3-propan-2-ylidenecyclobutene?
The canonical SMILES for 1-butyl-3-propan-2-ylidenecyclobutene is CCCCC1=CC(=C(C)C)C1.
What is the InChIKey of 1-butyl-3-propan-2-ylidenecyclobutene?
The InChIKey is AAPLPBVHRAUMCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18/c1-4-5-6-10-7-11(8-10)9(2)3/h7H,4-6,8H2,1-3H3.
What are the key properties of 1-butyl-3-propan-2-ylidenecyclobutene?
1-butyl-3-propan-2-ylidenecyclobutene has a molecular weight of 150.26 g/mol, XLogP of 3.84, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-butyl-3-propan-2-ylidenecyclobutene is sourced from PubChem (CID 10261257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).