2-fluoro-N-(3-methyloxolan-3-yl)benzamide

C12H14FNO2 — CID 115769256

IUPAC2-fluoro-N-(3-methyloxolan-3-yl)benzamide
SMILESCC1(NC(=O)c2ccccc2F)CCOC1
InChIInChI=1S/C12H14FNO2/c1-12(6-7-16-8-12)14-11(15)9-4-2-3-5-10(9)13/h2-5H,6-8H2,1H3,(H,14,15)
InChIKeySFSUPAIDKQXXHO-UHFFFAOYSA-N
MW223.25 g/mol
LogP1.73
Rot. Bonds2

About 2-fluoro-N-(3-methyloxolan-3-yl)benzamide

2-fluoro-N-(3-methyloxolan-3-yl)benzamide (PubChem CID 115769256) has the molecular formula C12H14FNO2 and a molecular weight of 223.25 g/mol. Its IUPAC name is 2-fluoro-N-(3-methyloxolan-3-yl)benzamide.

Molecular Properties

Compound Name2-fluoro-N-(3-methyloxolan-3-yl)benzamide
PubChem CID115769256
Molecular FormulaC12H14FNO2
Molecular Weight223.25 g/mol
Exact Mass223.10
IUPAC Name2-fluoro-N-(3-methyloxolan-3-yl)benzamide
SMILESCC1(NC(=O)c2ccccc2F)CCOC1
InChIInChI=1S/C12H14FNO2/c1-12(6-7-16-8-12)14-11(15)9-4-2-3-5-10(9)13/h2-5H,6-8H2,1H3,(H,14,15)
InChIKeySFSUPAIDKQXXHO-UHFFFAOYSA-N
XLogP1.73
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.25
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-chloro-2-fluoro-N-(3-methyloxolan-3-yl)benzamide
CID 115769264
2-fluoro-4-hydroxy-N-(3-methyloxolan-3-yl)benzamide
CID 104929999
5-chloro-2-fluoro-N-(3-methyloxan-3-yl)benzamide
CID 113347966
3-hydroxy-N-(3-methyloxolan-3-yl)naphthalene-2-carboxamide
CID 115769327
3-fluoro-2-hydrazinyl-N-(4-methyloxan-4-yl)benzamide
CID 113491319
2-hydroxy-N-(4-methyloxan-4-yl)benzamide
CID 113324402
3-fluoro-N-(3-methyloxan-3-yl)pyridine-4-carboxamide
CID 103897058
2,5-difluoro-N-(3-methyloxolan-3-yl)-4-nitrobenzamide
CID 115769248
3-amino-2,5-difluoro-N-(3-methyloxolan-3-yl)benzamide
CID 107121435
2-chloro-4,5-difluoro-N-(3-methyloxan-3-yl)benzamide
CID 122159233
2,5-dibromo-N-(3-methyloxolan-3-yl)benzamide
CID 114372910
2-chloro-5-hydroxy-N-(3-methyloxolan-3-yl)benzamide
CID 106502165

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-(3-methyloxolan-3-yl)benzamide?
The IUPAC name of 2-fluoro-N-(3-methyloxolan-3-yl)benzamide (CID 115769256) is 2-fluoro-N-(3-methyloxolan-3-yl)benzamide.
What is the SMILES notation for 2-fluoro-N-(3-methyloxolan-3-yl)benzamide?
The canonical SMILES for 2-fluoro-N-(3-methyloxolan-3-yl)benzamide is CC1(NC(=O)c2ccccc2F)CCOC1.
What is the InChIKey of 2-fluoro-N-(3-methyloxolan-3-yl)benzamide?
The InChIKey is SFSUPAIDKQXXHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14FNO2/c1-12(6-7-16-8-12)14-11(15)9-4-2-3-5-10(9)13/h2-5H,6-8H2,1H3,(H,14,15).
What are the key properties of 2-fluoro-N-(3-methyloxolan-3-yl)benzamide?
2-fluoro-N-(3-methyloxolan-3-yl)benzamide has a molecular weight of 223.25 g/mol, XLogP of 1.73, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-(3-methyloxolan-3-yl)benzamide is sourced from PubChem (CID 115769256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).