2-(2-fluoroethyl)-1-prop-1-en-2-ylazirine

C7H10FN — CID 146538205

IUPAC2-(2-fluoroethyl)-1-prop-1-en-2-ylazirine
SMILESC=C(C)N1C=C1CCF
InChIInChI=1S/C7H10FN/c1-6(2)9-5-7(9)3-4-8/h5H,1,3-4H2,2H3
InChIKeyCTYTUYAWYUHLIG-UHFFFAOYSA-N
MW127.16 g/mol
LogP2.04
Rot. Bonds3

About 2-(2-fluoroethyl)-1-prop-1-en-2-ylazirine

2-(2-fluoroethyl)-1-prop-1-en-2-ylazirine (PubChem CID 146538205) has the molecular formula C7H10FN and a molecular weight of 127.16 g/mol. Its IUPAC name is 2-(2-fluoroethyl)-1-prop-1-en-2-ylazirine.

Molecular Properties

Compound Name2-(2-fluoroethyl)-1-prop-1-en-2-ylazirine
PubChem CID146538205
Molecular FormulaC7H10FN
Molecular Weight127.16 g/mol
Exact Mass127.08
IUPAC Name2-(2-fluoroethyl)-1-prop-1-en-2-ylazirine
SMILESC=C(C)N1C=C1CCF
InChIInChI=1S/C7H10FN/c1-6(2)9-5-7(9)3-4-8/h5H,1,3-4H2,2H3
InChIKeyCTYTUYAWYUHLIG-UHFFFAOYSA-N
XLogP2.04
TPSA3.01 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.16
LogP ≤ 52.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 2-(2-fluoroethyl)-1-prop-1-en-2-ylazirine 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

N-(2-fluoropropyl)-N-methylbut-1-en-2-amine
CID 144557678
N-(1-fluoroethenyl)-N-methylbut-1-en-2-amine
CID 144946153
1-But-1-en-2-yl-3-fluoroazetidine
CID 146292685
1-But-1-en-2-ylaziridine
CID 59591112
N-ethenyl-N-ethylbut-1-en-2-amine
CID 88636622
2-Ethyl-1-propylazirine
CID 89242636
1-Ethyl-2-propylazirine
CID 89965103
N-ethyl-N-methylbut-1-en-2-amine
CID 90985662
2-Ethyl-1-methylazirine
CID 123690460
N-ethenyl-N-methylbut-1-en-2-amine
CID 134481091
1-Methyl-2-propylazirine
CID 154550384
1-Methyl-2-propan-2-ylazirine
CID 163485066

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluoroethyl)-1-prop-1-en-2-ylazirine?
The IUPAC name of 2-(2-fluoroethyl)-1-prop-1-en-2-ylazirine (CID 146538205) is 2-(2-fluoroethyl)-1-prop-1-en-2-ylazirine.
What is the SMILES notation for 2-(2-fluoroethyl)-1-prop-1-en-2-ylazirine?
The canonical SMILES for 2-(2-fluoroethyl)-1-prop-1-en-2-ylazirine is C=C(C)N1C=C1CCF.
What is the InChIKey of 2-(2-fluoroethyl)-1-prop-1-en-2-ylazirine?
The InChIKey is CTYTUYAWYUHLIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10FN/c1-6(2)9-5-7(9)3-4-8/h5H,1,3-4H2,2H3.
What are the key properties of 2-(2-fluoroethyl)-1-prop-1-en-2-ylazirine?
2-(2-fluoroethyl)-1-prop-1-en-2-ylazirine has a molecular weight of 127.16 g/mol, XLogP of 2.04, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluoroethyl)-1-prop-1-en-2-ylazirine is sourced from PubChem (CID 146538205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).