1-(3-methoxyprop-1-enyl)cyclopropene

C7H10O — CID 90887597

IUPAC1-(3-methoxyprop-1-enyl)cyclopropene
SMILESCOCC=CC1=CC1
InChIInChI=1S/C7H10O/c1-8-6-2-3-7-4-5-7/h2-4H,5-6H2,1H3
InChIKeyNRDQAYQBGDMPNI-UHFFFAOYSA-N
MW110.16 g/mol
LogP1.52
Rot. Bonds3

About 1-(3-methoxyprop-1-enyl)cyclopropene

1-(3-methoxyprop-1-enyl)cyclopropene (PubChem CID 90887597) has the molecular formula C7H10O and a molecular weight of 110.16 g/mol. Its IUPAC name is 1-(3-methoxyprop-1-enyl)cyclopropene.

Molecular Properties

Compound Name1-(3-methoxyprop-1-enyl)cyclopropene
PubChem CID90887597
Molecular FormulaC7H10O
Molecular Weight110.16 g/mol
Exact Mass110.07
IUPAC Name1-(3-methoxyprop-1-enyl)cyclopropene
SMILESCOCC=CC1=CC1
InChIInChI=1S/C7H10O/c1-8-6-2-3-7-4-5-7/h2-4H,5-6H2,1H3
InChIKeyNRDQAYQBGDMPNI-UHFFFAOYSA-N
XLogP1.52
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.16
LogP ≤ 51.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1-(3-methoxyprop-1-enyl)cyclopropene with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(3-methoxyprop-1-enyl)cyclopropene?
The IUPAC name of 1-(3-methoxyprop-1-enyl)cyclopropene (CID 90887597) is 1-(3-methoxyprop-1-enyl)cyclopropene.
What is the SMILES notation for 1-(3-methoxyprop-1-enyl)cyclopropene?
The canonical SMILES for 1-(3-methoxyprop-1-enyl)cyclopropene is COCC=CC1=CC1.
What is the InChIKey of 1-(3-methoxyprop-1-enyl)cyclopropene?
The InChIKey is NRDQAYQBGDMPNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10O/c1-8-6-2-3-7-4-5-7/h2-4H,5-6H2,1H3.
What are the key properties of 1-(3-methoxyprop-1-enyl)cyclopropene?
1-(3-methoxyprop-1-enyl)cyclopropene has a molecular weight of 110.16 g/mol, XLogP of 1.52, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methoxyprop-1-enyl)cyclopropene is sourced from PubChem (CID 90887597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).