N-[2-(ethylamino)-2-oxoethyl]-3-fluorobenzamide

C11H13FN2O2 — CID 60636583

IUPACN-[2-(ethylamino)-2-oxoethyl]-3-fluorobenzamide
SMILESCCNC(=O)CNC(=O)c1cccc(F)c1
InChIInChI=1S/C11H13FN2O2/c1-2-13-10(15)7-14-11(16)8-4-3-5-9(12)6-8/h3-6H,2,7H2,1H3,(H,13,15)(H,14,16)
InChIKeyATTGELUMJXUAMN-UHFFFAOYSA-N
MW224.24 g/mol
LogP0.69
Rot. Bonds4

About N-[2-(ethylamino)-2-oxoethyl]-3-fluorobenzamide

N-[2-(ethylamino)-2-oxoethyl]-3-fluorobenzamide (PubChem CID 60636583) has the molecular formula C11H13FN2O2 and a molecular weight of 224.24 g/mol. Its IUPAC name is N-[2-(ethylamino)-2-oxoethyl]-3-fluorobenzamide.

Molecular Properties

Compound NameN-[2-(ethylamino)-2-oxoethyl]-3-fluorobenzamide
PubChem CID60636583
Molecular FormulaC11H13FN2O2
Molecular Weight224.24 g/mol
Exact Mass224.10
IUPAC NameN-[2-(ethylamino)-2-oxoethyl]-3-fluorobenzamide
SMILESCCNC(=O)CNC(=O)c1cccc(F)c1
InChIInChI=1S/C11H13FN2O2/c1-2-13-10(15)7-14-11(16)8-4-3-5-9(12)6-8/h3-6H,2,7H2,1H3,(H,13,15)(H,14,16)
InChIKeyATTGELUMJXUAMN-UHFFFAOYSA-N
XLogP0.69
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.24
LogP ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(butylamino)-2-oxoethyl]-3-fluorobenzamide
CID 78784679
N-[2-(2,6-diethylanilino)-2-oxoethyl]-3-fluorobenzamide
CID 112997286
N-[2-(ethylamino)-2-oxoethyl]-3-propylbenzamide
CID 71109879
3-fluoro-N-[2-[(2-methylpropan-2-yl)oxyamino]-2-oxoethyl]benzamide
CID 82725712
3-fluoro-N-[2-(4-hydroxypentylamino)-2-oxoethyl]benzamide
CID 107299544
N-(3,3-dimethyl-2-oxobutyl)-3-fluorobenzamide
CID 64991573
ethane;N-ethyl-3-methylbenzamide;1-fluoro-3-methylbenzene
CID 142892736
N-[2-[(3-ethoxyphenyl)methylamino]-2-oxoethyl]-3-fluorobenzamide
CID 78900659
N-[2-[[3-(diethylaminomethyl)phenyl]methylamino]-2-oxoethyl]-3-fluorobenzamide
CID 78902086
3-fluoro-N-[2-oxo-2-(3-propan-2-yloxypropylamino)ethyl]benzamide
CID 78785991
3-fluoro-N-[2-oxo-2-[(2Z)-2-(1-phenylbutylidene)hydrazinyl]ethyl]benzamide
CID 6032270
methyl 3-[[2-[(3-fluorobenzoyl)amino]acetyl]amino]butanoate
CID 78825239

Frequently Asked Questions

What is the IUPAC name of N-[2-(ethylamino)-2-oxoethyl]-3-fluorobenzamide?
The IUPAC name of N-[2-(ethylamino)-2-oxoethyl]-3-fluorobenzamide (CID 60636583) is N-[2-(ethylamino)-2-oxoethyl]-3-fluorobenzamide.
What is the SMILES notation for N-[2-(ethylamino)-2-oxoethyl]-3-fluorobenzamide?
The canonical SMILES for N-[2-(ethylamino)-2-oxoethyl]-3-fluorobenzamide is CCNC(=O)CNC(=O)c1cccc(F)c1.
What is the InChIKey of N-[2-(ethylamino)-2-oxoethyl]-3-fluorobenzamide?
The InChIKey is ATTGELUMJXUAMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FN2O2/c1-2-13-10(15)7-14-11(16)8-4-3-5-9(12)6-8/h3-6H,2,7H2,1H3,(H,13,15)(H,14,16).
What are the key properties of N-[2-(ethylamino)-2-oxoethyl]-3-fluorobenzamide?
N-[2-(ethylamino)-2-oxoethyl]-3-fluorobenzamide has a molecular weight of 224.24 g/mol, XLogP of 0.69, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(ethylamino)-2-oxoethyl]-3-fluorobenzamide is sourced from PubChem (CID 60636583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).