N-[(2R)-1-(3-fluoroazetidin-1-yl)-1-oxobutan-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetamide

C13H23FN2O3 — CID 163706901

IUPACN-[(2R)-1-(3-fluoroazetidin-1-yl)-1-oxobutan-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetamide
SMILESCC[C@@H](NC(=O)COC(C)(C)C)C(=O)N1CC(F)C1
InChIInChI=1S/C13H23FN2O3/c1-5-10(12(18)16-6-9(14)7-16)15-11(17)8-19-13(2,3)4/h9-10H,5-8H2,1-4H3,(H,15,17)/t10-/m1/s1
InChIKeyKFVXAARIXXRCGV-SNVBAGLBSA-N
MW274.34 g/mol
LogP0.88
Rot. Bonds5

About N-[(2R)-1-(3-fluoroazetidin-1-yl)-1-oxobutan-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetamide

N-[(2R)-1-(3-fluoroazetidin-1-yl)-1-oxobutan-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetamide (PubChem CID 163706901) has the molecular formula C13H23FN2O3 and a molecular weight of 274.34 g/mol. Its IUPAC name is N-[(2R)-1-(3-fluoroazetidin-1-yl)-1-oxobutan-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetamide.

Molecular Properties

Compound NameN-[(2R)-1-(3-fluoroazetidin-1-yl)-1-oxobutan-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetamide
PubChem CID163706901
Molecular FormulaC13H23FN2O3
Molecular Weight274.34 g/mol
Exact Mass274.17
IUPAC NameN-[(2R)-1-(3-fluoroazetidin-1-yl)-1-oxobutan-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetamide
SMILESCC[C@@H](NC(=O)COC(C)(C)C)C(=O)N1CC(F)C1
InChIInChI=1S/C13H23FN2O3/c1-5-10(12(18)16-6-9(14)7-16)15-11(17)8-19-13(2,3)4/h9-10H,5-8H2,1-4H3,(H,15,17)/t10-/m1/s1
InChIKeyKFVXAARIXXRCGV-SNVBAGLBSA-N
XLogP0.88
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.34
LogP ≤ 50.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[(2R)-1-(3-fluoroazetidin-1-yl)-1-oxobutan-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetamide 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-(1-acetylazetidin-3-yl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 136521272
N-(2-(tert-Butoxymethyl)-1-butyl-4-oxo-3-azetidinyl)acetamide
CID 365795
(2S)-N-(2,2-difluoroethyl)-2-[(2-methoxyacetyl)amino]-N,3-dimethylbutanamide
CID 72001919
2-[methyl-[2-(3-methylazetidin-3-yl)oxyacetyl]amino]-N-(2,2,2-trifluoroethyl)acetamide
CID 102611251
N,N-dimethyl-2-[[2-(3-methylazetidin-3-yl)oxyacetyl]-(2,2,2-trifluoroethyl)amino]acetamide
CID 102655902
(2R)-N-(2,2-difluoroethyl)-N-(2-methoxyethyl)azetidine-2-carboxamide
CID 120452371
1-[3-Methoxy-3-(trifluoromethyl)azetidin-1-yl]-2-(methylamino)butan-1-one
CID 162614641
(2S)-N-[[1-(2-ethoxyacetyl)azetidin-2-yl]methyl]-3-methyl-2-[(2,2,2-trifluoroacetyl)amino]butanamide
CID 166396774
N-ethyl-2-ethyl-N-[2-(ethylamino)-2-oxoethyl]-2-methoxybutanamide;yttrium
CID 59870391
N-(azetidin-3-yl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112603468
ethane;N-[2-[methyl-[2-[(2-propan-2-yloxyacetyl)amino]ethyl]amino]ethyl]-1-propylazetidine-2-carboxamide
CID 154671529
N-[2-[methyl-[2-[(2-propan-2-yloxyacetyl)amino]ethyl]amino]ethyl]-1-propylazetidine-2-carboxamide
CID 154671530

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-(3-fluoroazetidin-1-yl)-1-oxobutan-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetamide?
The IUPAC name of N-[(2R)-1-(3-fluoroazetidin-1-yl)-1-oxobutan-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetamide (CID 163706901) is N-[(2R)-1-(3-fluoroazetidin-1-yl)-1-oxobutan-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetamide.
What is the SMILES notation for N-[(2R)-1-(3-fluoroazetidin-1-yl)-1-oxobutan-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetamide?
The canonical SMILES for N-[(2R)-1-(3-fluoroazetidin-1-yl)-1-oxobutan-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetamide is CC[C@@H](NC(=O)COC(C)(C)C)C(=O)N1CC(F)C1.
What is the InChIKey of N-[(2R)-1-(3-fluoroazetidin-1-yl)-1-oxobutan-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetamide?
The InChIKey is KFVXAARIXXRCGV-SNVBAGLBSA-N. The full InChI is InChI=1S/C13H23FN2O3/c1-5-10(12(18)16-6-9(14)7-16)15-11(17)8-19-13(2,3)4/h9-10H,5-8H2,1-4H3,(H,15,17)/t10-/m1/s1.
What are the key properties of N-[(2R)-1-(3-fluoroazetidin-1-yl)-1-oxobutan-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetamide?
N-[(2R)-1-(3-fluoroazetidin-1-yl)-1-oxobutan-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetamide has a molecular weight of 274.34 g/mol, XLogP of 0.88, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-(3-fluoroazetidin-1-yl)-1-oxobutan-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetamide is sourced from PubChem (CID 163706901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).