2-(1-fluoro-2,2-dimethylpropyl)azetidine

C8H16FN — CID 115058320

IUPAC2-(1-fluoro-2,2-dimethylpropyl)azetidine
SMILESCC(C)(C)C(F)C1CCN1
InChIInChI=1S/C8H16FN/c1-8(2,3)7(9)6-4-5-10-6/h6-7,10H,4-5H2,1-3H3
InChIKeyRCVCCIDEAXJNJI-UHFFFAOYSA-N
MW145.22 g/mol
LogP1.73
Rot. Bonds1

About 2-(1-fluoro-2,2-dimethylpropyl)azetidine

2-(1-fluoro-2,2-dimethylpropyl)azetidine (PubChem CID 115058320) has the molecular formula C8H16FN and a molecular weight of 145.22 g/mol. Its IUPAC name is 2-(1-fluoro-2,2-dimethylpropyl)azetidine.

Molecular Properties

Compound Name2-(1-fluoro-2,2-dimethylpropyl)azetidine
PubChem CID115058320
Molecular FormulaC8H16FN
Molecular Weight145.22 g/mol
Exact Mass145.13
IUPAC Name2-(1-fluoro-2,2-dimethylpropyl)azetidine
SMILESCC(C)(C)C(F)C1CCN1
InChIInChI=1S/C8H16FN/c1-8(2,3)7(9)6-4-5-10-6/h6-7,10H,4-5H2,1-3H3
InChIKeyRCVCCIDEAXJNJI-UHFFFAOYSA-N
XLogP1.73
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.22
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-Cyclopropyl-3,3-dimethylazetidine hydrochloride
CID 119031645
2-(2-Fluoropropan-2-yl)azetidine hydrochloride
CID 177801862
2-Tert-butyl-3-fluoropyrrolidine
CID 83855238
2-Tert-butyl-4-fluoropyrrolidine
CID 83855240
N-tert-butyl-2-fluoro-5,5-dimethylhexan-1-amine
CID 107446549
2,2-dimethyl-N-(1,1,1-trifluoropropan-2-yl)hexan-1-amine
CID 122599078
2,2-dimethyl-N-[(2S)-1,1,1-trifluoropropan-2-yl]hexan-1-amine
CID 122599122
2,2-dimethyl-N-[(2R)-1,1,1-trifluoropropan-2-yl]hexan-1-amine
CID 122599130
N-(2-fluoroethyl)-4,4-dimethylpentan-1-amine
CID 129033932
N-(2-fluoroethyl)-4,4-dimethylhexan-1-amine
CID 129033933
N-tert-butyl-4-fluoro-2,2,5,5-tetramethylhexan-3-amine
CID 132123153
N-[(3-fluoro-1,3-dimethylcyclobutyl)methyl]ethanamine
CID 144053308

Frequently Asked Questions

What is the IUPAC name of 2-(1-fluoro-2,2-dimethylpropyl)azetidine?
The IUPAC name of 2-(1-fluoro-2,2-dimethylpropyl)azetidine (CID 115058320) is 2-(1-fluoro-2,2-dimethylpropyl)azetidine.
What is the SMILES notation for 2-(1-fluoro-2,2-dimethylpropyl)azetidine?
The canonical SMILES for 2-(1-fluoro-2,2-dimethylpropyl)azetidine is CC(C)(C)C(F)C1CCN1.
What is the InChIKey of 2-(1-fluoro-2,2-dimethylpropyl)azetidine?
The InChIKey is RCVCCIDEAXJNJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16FN/c1-8(2,3)7(9)6-4-5-10-6/h6-7,10H,4-5H2,1-3H3.
What are the key properties of 2-(1-fluoro-2,2-dimethylpropyl)azetidine?
2-(1-fluoro-2,2-dimethylpropyl)azetidine has a molecular weight of 145.22 g/mol, XLogP of 1.73, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-fluoro-2,2-dimethylpropyl)azetidine is sourced from PubChem (CID 115058320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).