2-(ethylamino)-4,5-difluorobenzamide

C9H10F2N2O — CID 174841980

IUPAC2-(ethylamino)-4,5-difluorobenzamide
SMILESCCNc1cc(F)c(F)cc1C(N)=O
InChIInChI=1S/C9H10F2N2O/c1-2-13-8-4-7(11)6(10)3-5(8)9(12)14/h3-4,13H,2H2,1H3,(H2,12,14)
InChIKeyIDVZBPOPMDPFDU-UHFFFAOYSA-N
MW200.19 g/mol
LogP1.50
Rot. Bonds3

About 2-(ethylamino)-4,5-difluorobenzamide

2-(ethylamino)-4,5-difluorobenzamide (PubChem CID 174841980) has the molecular formula C9H10F2N2O and a molecular weight of 200.19 g/mol. Its IUPAC name is 2-(ethylamino)-4,5-difluorobenzamide.

Molecular Properties

Compound Name2-(ethylamino)-4,5-difluorobenzamide
PubChem CID174841980
Molecular FormulaC9H10F2N2O
Molecular Weight200.19 g/mol
Exact Mass200.08
IUPAC Name2-(ethylamino)-4,5-difluorobenzamide
SMILESCCNc1cc(F)c(F)cc1C(N)=O
InChIInChI=1S/C9H10F2N2O/c1-2-13-8-4-7(11)6(10)3-5(8)9(12)14/h3-4,13H,2H2,1H3,(H2,12,14)
InChIKeyIDVZBPOPMDPFDU-UHFFFAOYSA-N
XLogP1.50
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.19
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-(ethylamino)-2,4-difluorobenzoic acid
CID 43737186
3-(ethylamino)-2-(hydroxymethyl)-5-(trifluoromethyl)benzamide
CID 70106435
2-amino-4,5-difluorobenzamide
CID 16640510
2-[(2,4,5-trifluoroanilino)methyl]benzamide
CID 62815579
methyl 4-carbamoyl-2-fluoro-5-(pentan-3-ylamino)benzoate
CID 67403888
2-carbamothioyl-2-methyl-N-(2,4,5-trifluorophenyl)butanamide
CID 114292239
1-[4-(azepan-1-yl)-2-(ethylamino)-5-fluorophenyl]ethanone
CID 178026604
2-carbamoyl-4,5-difluorobenzenesulfonic acid
CID 157144700
2-[[2-(ethylamino)benzoyl]amino]benzamide
CID 63107722
4-[(2,4,5-trifluoroanilino)methyl]benzamide
CID 62815712
2-[(2-amino-2-methylpropyl)amino]-5-fluorobenzamide
CID 115303646
2-[(6-chloro-3-pyridinyl)methylamino]-5-fluoro-4-methylbenzamide
CID 71978030

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-4,5-difluorobenzamide?
The IUPAC name of 2-(ethylamino)-4,5-difluorobenzamide (CID 174841980) is 2-(ethylamino)-4,5-difluorobenzamide.
What is the SMILES notation for 2-(ethylamino)-4,5-difluorobenzamide?
The canonical SMILES for 2-(ethylamino)-4,5-difluorobenzamide is CCNc1cc(F)c(F)cc1C(N)=O.
What is the InChIKey of 2-(ethylamino)-4,5-difluorobenzamide?
The InChIKey is IDVZBPOPMDPFDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10F2N2O/c1-2-13-8-4-7(11)6(10)3-5(8)9(12)14/h3-4,13H,2H2,1H3,(H2,12,14).
What are the key properties of 2-(ethylamino)-4,5-difluorobenzamide?
2-(ethylamino)-4,5-difluorobenzamide has a molecular weight of 200.19 g/mol, XLogP of 1.50, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-4,5-difluorobenzamide is sourced from PubChem (CID 174841980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).