2-fluoro-1-propan-2-ylaziridine

C5H10FN — CID 166046401

IUPAC2-fluoro-1-propan-2-ylaziridine
SMILESCC(C)N1CC1F
InChIInChI=1S/C5H10FN/c1-4(2)7-3-5(7)6/h4-5H,3H2,1-2H3
InChIKeyDCLIYWPHSFXXFE-UHFFFAOYSA-N
MW103.14 g/mol
LogP1.01
Rot. Bonds1

About 2-fluoro-1-propan-2-ylaziridine

2-fluoro-1-propan-2-ylaziridine (PubChem CID 166046401) has the molecular formula C5H10FN and a molecular weight of 103.14 g/mol. Its IUPAC name is 2-fluoro-1-propan-2-ylaziridine.

Molecular Properties

Compound Name2-fluoro-1-propan-2-ylaziridine
PubChem CID166046401
Molecular FormulaC5H10FN
Molecular Weight103.14 g/mol
Exact Mass103.08
IUPAC Name2-fluoro-1-propan-2-ylaziridine
SMILESCC(C)N1CC1F
InChIInChI=1S/C5H10FN/c1-4(2)7-3-5(7)6/h4-5H,3H2,1-2H3
InChIKeyDCLIYWPHSFXXFE-UHFFFAOYSA-N
XLogP1.01
TPSA3.01 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500103.14
LogP ≤ 51.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-C-halo', 'substructure': 'N/A'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

Analyze 2-fluoro-1-propan-2-ylaziridine 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

2-fluoro-1,3-di(propan-2-yl)imidazolidine
CID 70243177
1-propan-2-yl-2-(trifluoromethyl)aziridine
CID 166046410
1-(1-propan-2-ylaziridin-2-yl)ethanone
CID 160809757
3-fluoro-4-propan-2-ylmorpholine
CID 141026156
(2R)-4-fluoro-2-isocyano-1-propan-2-ylpyrrolidine
CID 176768906
(3S,5R)-3,5-difluoro-1-propan-2-ylpiperidine
CID 176851982
7,7-dimethyl-2,5-di(propan-2-yl)-2,5-diazabicyclo[2.2.1]heptane
CID 121400498
(2R)-2-ethyl-1-propan-2-ylaziridine
CID 59459524
6-fluoro-1,4-di(propan-2-yl)-1,4-diazepane
CID 153291266
(2R,3S)-2-ethyl-3-fluoro-1-propan-2-ylpyrrolidine
CID 146374292
1,2,2,3,3,5-hexafluoro-4-propan-2-ylpiperazine
CID 150456202
ethane;5-fluoro-5-methyl-2-propan-2-yl-2-azabicyclo[2.2.0]hexane
CID 171508934

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-1-propan-2-ylaziridine?
The IUPAC name of 2-fluoro-1-propan-2-ylaziridine (CID 166046401) is 2-fluoro-1-propan-2-ylaziridine.
What is the SMILES notation for 2-fluoro-1-propan-2-ylaziridine?
The canonical SMILES for 2-fluoro-1-propan-2-ylaziridine is CC(C)N1CC1F.
What is the InChIKey of 2-fluoro-1-propan-2-ylaziridine?
The InChIKey is DCLIYWPHSFXXFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10FN/c1-4(2)7-3-5(7)6/h4-5H,3H2,1-2H3.
What are the key properties of 2-fluoro-1-propan-2-ylaziridine?
2-fluoro-1-propan-2-ylaziridine has a molecular weight of 103.14 g/mol, XLogP of 1.01, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-1-propan-2-ylaziridine is sourced from PubChem (CID 166046401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).