2-(azetidin-3-yl)-N-[1-(2,6-difluorophenyl)propan-2-yl]acetamide

C14H18F2N2O — CID 64618985

IUPAC2-(azetidin-3-yl)-N-[1-(2,6-difluorophenyl)propan-2-yl]acetamide
SMILESCC(Cc1c(F)cccc1F)NC(=O)CC1CNC1
InChIInChI=1S/C14H18F2N2O/c1-9(18-14(19)6-10-7-17-8-10)5-11-12(15)3-2-4-13(11)16/h2-4,9-10,17H,5-8H2,1H3,(H,18,19)
InChIKeyQLBVYMZRZLICRI-UHFFFAOYSA-N
MW268.31 g/mol
LogP1.62
Rot. Bonds5

About 2-(azetidin-3-yl)-N-[1-(2,6-difluorophenyl)propan-2-yl]acetamide

2-(azetidin-3-yl)-N-[1-(2,6-difluorophenyl)propan-2-yl]acetamide (PubChem CID 64618985) has the molecular formula C14H18F2N2O and a molecular weight of 268.31 g/mol. Its IUPAC name is 2-(azetidin-3-yl)-N-[1-(2,6-difluorophenyl)propan-2-yl]acetamide.

Molecular Properties

Compound Name2-(azetidin-3-yl)-N-[1-(2,6-difluorophenyl)propan-2-yl]acetamide
PubChem CID64618985
Molecular FormulaC14H18F2N2O
Molecular Weight268.31 g/mol
Exact Mass268.14
IUPAC Name2-(azetidin-3-yl)-N-[1-(2,6-difluorophenyl)propan-2-yl]acetamide
SMILESCC(Cc1c(F)cccc1F)NC(=O)CC1CNC1
InChIInChI=1S/C14H18F2N2O/c1-9(18-14(19)6-10-7-17-8-10)5-11-12(15)3-2-4-13(11)16/h2-4,9-10,17H,5-8H2,1H3,(H,18,19)
InChIKeyQLBVYMZRZLICRI-UHFFFAOYSA-N
XLogP1.62
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.31
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(azetidin-3-yl)-N-[1-(furan-2-yl)propan-2-yl]acetamide
CID 64617974
1,3-bis[(2R)-1-(2,6-difluorophenyl)propan-2-yl]urea
CID 95141541
N-[1-(2,6-difluorophenyl)propan-2-yl]-3-(ethylamino)butanamide
CID 62837413
2-(azetidin-3-yl)-N-(4-phenylbutan-2-yl)acetamide
CID 64611423
N-[1-(2,6-difluorophenyl)propan-2-yl]cyclopropanecarboxamide
CID 61027207
2-(azetidin-3-yl)-N-(1-hydroxypropan-2-yl)acetamide
CID 64616757
N-[1-(4-fluorophenyl)propan-2-yl]-2-piperidin-3-ylacetamide
CID 63010220
2-(azetidin-3-yl)-N-propan-2-ylacetamide
CID 64616125
N-[(2S)-1-(2,6-difluorophenyl)propan-2-yl]-2-[(1R,2R,6S,7R)-3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl]acetamide
CID 98288474
N-[1-(2,6-difluorophenyl)propan-2-yl]prop-2-enamide
CID 60932780
2-bromo-N-[1-(2,6-difluorophenyl)propan-2-yl]-2-methylpropanamide
CID 114328026
N-[1-(2,6-difluorophenyl)propan-2-yl]pyrrolidine-1-carboxamide
CID 60541693

Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-3-yl)-N-[1-(2,6-difluorophenyl)propan-2-yl]acetamide?
The IUPAC name of 2-(azetidin-3-yl)-N-[1-(2,6-difluorophenyl)propan-2-yl]acetamide (CID 64618985) is 2-(azetidin-3-yl)-N-[1-(2,6-difluorophenyl)propan-2-yl]acetamide.
What is the SMILES notation for 2-(azetidin-3-yl)-N-[1-(2,6-difluorophenyl)propan-2-yl]acetamide?
The canonical SMILES for 2-(azetidin-3-yl)-N-[1-(2,6-difluorophenyl)propan-2-yl]acetamide is CC(Cc1c(F)cccc1F)NC(=O)CC1CNC1.
What is the InChIKey of 2-(azetidin-3-yl)-N-[1-(2,6-difluorophenyl)propan-2-yl]acetamide?
The InChIKey is QLBVYMZRZLICRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18F2N2O/c1-9(18-14(19)6-10-7-17-8-10)5-11-12(15)3-2-4-13(11)16/h2-4,9-10,17H,5-8H2,1H3,(H,18,19).
What are the key properties of 2-(azetidin-3-yl)-N-[1-(2,6-difluorophenyl)propan-2-yl]acetamide?
2-(azetidin-3-yl)-N-[1-(2,6-difluorophenyl)propan-2-yl]acetamide has a molecular weight of 268.31 g/mol, XLogP of 1.62, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azetidin-3-yl)-N-[1-(2,6-difluorophenyl)propan-2-yl]acetamide is sourced from PubChem (CID 64618985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).