N-cyclopentyl-2-[2-(4-fluorophenyl)-4-oxoazetidin-1-yl]-2-methylbutanamide

C19H25FN2O2 — CID 43822315

IUPACN-cyclopentyl-2-[2-(4-fluorophenyl)-4-oxoazetidin-1-yl]-2-methylbutanamide
SMILESCCC(C)(C(=O)NC1CCCC1)N1C(=O)CC1c1ccc(F)cc1
InChIInChI=1S/C19H25FN2O2/c1-3-19(2,18(24)21-15-6-4-5-7-15)22-16(12-17(22)23)13-8-10-14(20)11-9-13/h8-11,15-16H,3-7,12H2,1-2H3,(H,21,24)
InChIKeyUEHCMMAGRFTMAU-UHFFFAOYSA-N
MW332.42 g/mol
LogP3.33
Rot. Bonds5

About N-cyclopentyl-2-[2-(4-fluorophenyl)-4-oxoazetidin-1-yl]-2-methylbutanamide

N-cyclopentyl-2-[2-(4-fluorophenyl)-4-oxoazetidin-1-yl]-2-methylbutanamide (PubChem CID 43822315) has the molecular formula C19H25FN2O2 and a molecular weight of 332.42 g/mol. Its IUPAC name is N-cyclopentyl-2-[2-(4-fluorophenyl)-4-oxoazetidin-1-yl]-2-methylbutanamide.

Molecular Properties

Compound NameN-cyclopentyl-2-[2-(4-fluorophenyl)-4-oxoazetidin-1-yl]-2-methylbutanamide
PubChem CID43822315
Molecular FormulaC19H25FN2O2
Molecular Weight332.42 g/mol
Exact Mass332.19
IUPAC NameN-cyclopentyl-2-[2-(4-fluorophenyl)-4-oxoazetidin-1-yl]-2-methylbutanamide
SMILESCCC(C)(C(=O)NC1CCCC1)N1C(=O)CC1c1ccc(F)cc1
InChIInChI=1S/C19H25FN2O2/c1-3-19(2,18(24)21-15-6-4-5-7-15)22-16(12-17(22)23)13-8-10-14(20)11-9-13/h8-11,15-16H,3-7,12H2,1-2H3,(H,21,24)
InChIKeyUEHCMMAGRFTMAU-UHFFFAOYSA-N
XLogP3.33
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.42
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopentyl-2-methyl-2-(2-oxo-4-phenylazetidin-1-yl)propanamide
CID 43822310
N-cyclopentyl-2,2-dimethylbutanamide
CID 4627793
4-tert-butyl-1-[2-(4-fluorophenyl)-2-oxoethyl]pyrrolidin-2-one
CID 104512255
N-cyclopropyl-N'-[(4-fluorophenyl)methyl]-2,2-dimethylpropanediamide
CID 108957398
N-cyclopentyl-2-(4-fluorophenyl)-1-methyl-6-oxopiperidine-3-carboxamide
CID 75538273
3,3-difluoro-1-[(2R)-2-(4-fluorophenyl)piperidin-1-yl]butan-1-one
CID 124890583
tert-butyl N-[1-[2-(4-fluorophenyl)-2-oxoethyl]piperidin-4-yl]carbamate
CID 56771206
1-cyclopentyl-3-[2-(4-fluorophenyl)propan-2-yl]urea
CID 110469730
N-cyclooctyl-2-[4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
CID 51250040
1-cycloheptyl-3-[2-(4-fluorophenyl)propan-2-yl]urea
CID 113216151
1-cyclopentyl-3-[1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]urea
CID 43970310
1-cyclopentyl-3-[(3R)-1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]urea
CID 7548061

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-[2-(4-fluorophenyl)-4-oxoazetidin-1-yl]-2-methylbutanamide?
The IUPAC name of N-cyclopentyl-2-[2-(4-fluorophenyl)-4-oxoazetidin-1-yl]-2-methylbutanamide (CID 43822315) is N-cyclopentyl-2-[2-(4-fluorophenyl)-4-oxoazetidin-1-yl]-2-methylbutanamide.
What is the SMILES notation for N-cyclopentyl-2-[2-(4-fluorophenyl)-4-oxoazetidin-1-yl]-2-methylbutanamide?
The canonical SMILES for N-cyclopentyl-2-[2-(4-fluorophenyl)-4-oxoazetidin-1-yl]-2-methylbutanamide is CCC(C)(C(=O)NC1CCCC1)N1C(=O)CC1c1ccc(F)cc1.
What is the InChIKey of N-cyclopentyl-2-[2-(4-fluorophenyl)-4-oxoazetidin-1-yl]-2-methylbutanamide?
The InChIKey is UEHCMMAGRFTMAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25FN2O2/c1-3-19(2,18(24)21-15-6-4-5-7-15)22-16(12-17(22)23)13-8-10-14(20)11-9-13/h8-11,15-16H,3-7,12H2,1-2H3,(H,21,24).
What are the key properties of N-cyclopentyl-2-[2-(4-fluorophenyl)-4-oxoazetidin-1-yl]-2-methylbutanamide?
N-cyclopentyl-2-[2-(4-fluorophenyl)-4-oxoazetidin-1-yl]-2-methylbutanamide has a molecular weight of 332.42 g/mol, XLogP of 3.33, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-[2-(4-fluorophenyl)-4-oxoazetidin-1-yl]-2-methylbutanamide is sourced from PubChem (CID 43822315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).