1-[3-[(Z)-2-fluoroethenyl]azetidin-1-yl]pentan-1-one

C10H16FNO — CID 155738155

IUPAC1-[3-[(Z)-2-fluoroethenyl]azetidin-1-yl]pentan-1-one
SMILESCCCCC(=O)N1CC(/C=C\F)C1
InChIInChI=1S/C10H16FNO/c1-2-3-4-10(13)12-7-9(8-12)5-6-11/h5-6,9H,2-4,7-8H2,1H3/b6-5-
InChIKeyAJLGVWZWHRNGFW-WAYWQWQTSA-N
MW185.24 g/mol
LogP2.12
Rot. Bonds4

About 1-[3-[(Z)-2-fluoroethenyl]azetidin-1-yl]pentan-1-one

1-[3-[(Z)-2-fluoroethenyl]azetidin-1-yl]pentan-1-one (PubChem CID 155738155) has the molecular formula C10H16FNO and a molecular weight of 185.24 g/mol. Its IUPAC name is 1-[3-[(Z)-2-fluoroethenyl]azetidin-1-yl]pentan-1-one.

Molecular Properties

Compound Name1-[3-[(Z)-2-fluoroethenyl]azetidin-1-yl]pentan-1-one
PubChem CID155738155
Molecular FormulaC10H16FNO
Molecular Weight185.24 g/mol
Exact Mass185.12
IUPAC Name1-[3-[(Z)-2-fluoroethenyl]azetidin-1-yl]pentan-1-one
SMILESCCCCC(=O)N1CC(/C=C\F)C1
InChIInChI=1S/C10H16FNO/c1-2-3-4-10(13)12-7-9(8-12)5-6-11/h5-6,9H,2-4,7-8H2,1H3/b6-5-
InChIKeyAJLGVWZWHRNGFW-WAYWQWQTSA-N
XLogP2.12
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.24
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1-[3-[(Z)-2-fluoroethenyl]azetidin-1-yl]pentan-1-one 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-[(Z)-2-fluoroethenyl]azetidin-1-yl]pentan-1-one?
The IUPAC name of 1-[3-[(Z)-2-fluoroethenyl]azetidin-1-yl]pentan-1-one (CID 155738155) is 1-[3-[(Z)-2-fluoroethenyl]azetidin-1-yl]pentan-1-one.
What is the SMILES notation for 1-[3-[(Z)-2-fluoroethenyl]azetidin-1-yl]pentan-1-one?
The canonical SMILES for 1-[3-[(Z)-2-fluoroethenyl]azetidin-1-yl]pentan-1-one is CCCCC(=O)N1CC(/C=C\F)C1.
What is the InChIKey of 1-[3-[(Z)-2-fluoroethenyl]azetidin-1-yl]pentan-1-one?
The InChIKey is AJLGVWZWHRNGFW-WAYWQWQTSA-N. The full InChI is InChI=1S/C10H16FNO/c1-2-3-4-10(13)12-7-9(8-12)5-6-11/h5-6,9H,2-4,7-8H2,1H3/b6-5-.
What are the key properties of 1-[3-[(Z)-2-fluoroethenyl]azetidin-1-yl]pentan-1-one?
1-[3-[(Z)-2-fluoroethenyl]azetidin-1-yl]pentan-1-one has a molecular weight of 185.24 g/mol, XLogP of 2.12, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-[(Z)-2-fluoroethenyl]azetidin-1-yl]pentan-1-one is sourced from PubChem (CID 155738155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).