N-[2-(2-fluorophenyl)-2-methylpropyl]azetidine-3-carboxamide

C14H19FN2O — CID 115159146

IUPACN-[2-(2-fluorophenyl)-2-methylpropyl]azetidine-3-carboxamide
SMILESCC(C)(CNC(=O)C1CNC1)c1ccccc1F
InChIInChI=1S/C14H19FN2O/c1-14(2,11-5-3-4-6-12(11)15)9-17-13(18)10-7-16-8-10/h3-6,10,16H,7-9H2,1-2H3,(H,17,18)
InChIKeyJHZQBUQENHPWAV-UHFFFAOYSA-N
MW250.32 g/mol
LogP1.44
Rot. Bonds4

About N-[2-(2-fluorophenyl)-2-methylpropyl]azetidine-3-carboxamide

N-[2-(2-fluorophenyl)-2-methylpropyl]azetidine-3-carboxamide (PubChem CID 115159146) has the molecular formula C14H19FN2O and a molecular weight of 250.32 g/mol. Its IUPAC name is N-[2-(2-fluorophenyl)-2-methylpropyl]azetidine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(2-fluorophenyl)-2-methylpropyl]azetidine-3-carboxamide
PubChem CID115159146
Molecular FormulaC14H19FN2O
Molecular Weight250.32 g/mol
Exact Mass250.15
IUPAC NameN-[2-(2-fluorophenyl)-2-methylpropyl]azetidine-3-carboxamide
SMILESCC(C)(CNC(=O)C1CNC1)c1ccccc1F
InChIInChI=1S/C14H19FN2O/c1-14(2,11-5-3-4-6-12(11)15)9-17-13(18)10-7-16-8-10/h3-6,10,16H,7-9H2,1-2H3,(H,17,18)
InChIKeyJHZQBUQENHPWAV-UHFFFAOYSA-N
XLogP1.44
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.32
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-[2-(2-fluorophenyl)-2-methylpropyl]azetidine-3-carboxamide 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-Phenylethyl)-isobutyramide
CID 290550
N-[2-(4-fluorophenyl)ethyl]butanamide
CID 773504
2-methyl-N-(3-phenylpropyl)propanamide
CID 2906692
2-methyl-N-(2-phenylethyl)butanamide
CID 2905151
3-Methyl-n-(2-phenylethyl)butanamide
CID 3551002
3-Phenyl-2-azetidinone
CID 28389
2-Azetidinone, 3-ethyl-3-phenyl-
CID 29917
N-phenylethylpivalamide
CID 546250
N-[2-(cyclohexen-1-yl)-2-phenylpentyl]acetamide
CID 278462
2-cyano-N-[(1-phenylcyclopentyl)methyl]acetamide
CID 847345
2-ethyl-N-[2-(4-fluorophenyl)ethyl]butanamide
CID 890242
3-acetamido-N-[(4-fluorophenyl)methyl]propanamide
CID 2105511

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-fluorophenyl)-2-methylpropyl]azetidine-3-carboxamide?
The IUPAC name of N-[2-(2-fluorophenyl)-2-methylpropyl]azetidine-3-carboxamide (CID 115159146) is N-[2-(2-fluorophenyl)-2-methylpropyl]azetidine-3-carboxamide.
What is the SMILES notation for N-[2-(2-fluorophenyl)-2-methylpropyl]azetidine-3-carboxamide?
The canonical SMILES for N-[2-(2-fluorophenyl)-2-methylpropyl]azetidine-3-carboxamide is CC(C)(CNC(=O)C1CNC1)c1ccccc1F.
What is the InChIKey of N-[2-(2-fluorophenyl)-2-methylpropyl]azetidine-3-carboxamide?
The InChIKey is JHZQBUQENHPWAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN2O/c1-14(2,11-5-3-4-6-12(11)15)9-17-13(18)10-7-16-8-10/h3-6,10,16H,7-9H2,1-2H3,(H,17,18).
What are the key properties of N-[2-(2-fluorophenyl)-2-methylpropyl]azetidine-3-carboxamide?
N-[2-(2-fluorophenyl)-2-methylpropyl]azetidine-3-carboxamide has a molecular weight of 250.32 g/mol, XLogP of 1.44, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-fluorophenyl)-2-methylpropyl]azetidine-3-carboxamide is sourced from PubChem (CID 115159146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).