1-chloroethylidenecyclopropane

C5H7Cl — CID 70323801

IUPAC1-chloroethylidenecyclopropane
SMILESCC(Cl)=C1CC1
InChIInChI=1S/C5H7Cl/c1-4(6)5-2-3-5/h2-3H2,1H3
InChIKeyZVMFYPZNVOABPR-UHFFFAOYSA-N
MW102.56 g/mol
LogP2.29
Rot. Bonds

About 1-chloroethylidenecyclopropane

1-chloroethylidenecyclopropane (PubChem CID 70323801) has the molecular formula C5H7Cl and a molecular weight of 102.56 g/mol. Its IUPAC name is 1-chloroethylidenecyclopropane.

Molecular Properties

Compound Name1-chloroethylidenecyclopropane
PubChem CID70323801
Molecular FormulaC5H7Cl
Molecular Weight102.56 g/mol
Exact Mass102.02
IUPAC Name1-chloroethylidenecyclopropane
SMILESCC(Cl)=C1CC1
InChIInChI=1S/C5H7Cl/c1-4(6)5-2-3-5/h2-3H2,1H3
InChIKeyZVMFYPZNVOABPR-UHFFFAOYSA-N
XLogP2.29
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500102.56
LogP ≤ 52.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 1-chloroethylidenecyclopropane 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

(Z)-2-Chlor-3-methyl-2-penten
CID 14143293
(E)-2-chloro-3-methylpent-2-ene
CID 23505268
2-Chloro-3-methylpent-2-ene
CID 74057527
1-Chloropropylidenecyclopropane
CID 123724035

Frequently Asked Questions

What is the IUPAC name of 1-chloroethylidenecyclopropane?
The IUPAC name of 1-chloroethylidenecyclopropane (CID 70323801) is 1-chloroethylidenecyclopropane.
What is the SMILES notation for 1-chloroethylidenecyclopropane?
The canonical SMILES for 1-chloroethylidenecyclopropane is CC(Cl)=C1CC1.
What is the InChIKey of 1-chloroethylidenecyclopropane?
The InChIKey is ZVMFYPZNVOABPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7Cl/c1-4(6)5-2-3-5/h2-3H2,1H3.
What are the key properties of 1-chloroethylidenecyclopropane?
1-chloroethylidenecyclopropane has a molecular weight of 102.56 g/mol, XLogP of 2.29, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloroethylidenecyclopropane is sourced from PubChem (CID 70323801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).