N-ethyl-3-fluoro-2-hydrazinyl-N-(3-methylphenyl)benzamide

C16H18FN3O — CID 62660273

IUPACN-ethyl-3-fluoro-2-hydrazinyl-N-(3-methylphenyl)benzamide
SMILESCCN(C(=O)c1cccc(F)c1NN)c1cccc(C)c1
InChIInChI=1S/C16H18FN3O/c1-3-20(12-7-4-6-11(2)10-12)16(21)13-8-5-9-14(17)15(13)19-18/h4-10,19H,3,18H2,1-2H3
InChIKeyTXBSCADPUCVZNE-UHFFFAOYSA-N
MW287.34 g/mol
LogP3.09
Rot. Bonds4

About N-ethyl-3-fluoro-2-hydrazinyl-N-(3-methylphenyl)benzamide

N-ethyl-3-fluoro-2-hydrazinyl-N-(3-methylphenyl)benzamide (PubChem CID 62660273) has the molecular formula C16H18FN3O and a molecular weight of 287.34 g/mol. Its IUPAC name is N-ethyl-3-fluoro-2-hydrazinyl-N-(3-methylphenyl)benzamide.

Molecular Properties

Compound NameN-ethyl-3-fluoro-2-hydrazinyl-N-(3-methylphenyl)benzamide
PubChem CID62660273
Molecular FormulaC16H18FN3O
Molecular Weight287.34 g/mol
Exact Mass287.14
IUPAC NameN-ethyl-3-fluoro-2-hydrazinyl-N-(3-methylphenyl)benzamide
SMILESCCN(C(=O)c1cccc(F)c1NN)c1cccc(C)c1
InChIInChI=1S/C16H18FN3O/c1-3-20(12-7-4-6-11(2)10-12)16(21)13-8-5-9-14(17)15(13)19-18/h4-10,19H,3,18H2,1-2H3
InChIKeyTXBSCADPUCVZNE-UHFFFAOYSA-N
XLogP3.09
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.34
LogP ≤ 53.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-ethyl-4-fluoro-2-methyl-N-(3-methylphenyl)benzamide
CID 115745612
2-(2-amino-2-sulfanylideneethyl)-N-ethyl-N-(3-methylphenyl)benzamide
CID 94806445
N-ethyl-2-fluoro-N-(3-fluorophenyl)-4-methylbenzamide
CID 79769914
N-(3-carbamoylphenyl)-N-ethyl-2-fluorobenzamide
CID 67278413
N-(2,6-difluorophenyl)-2-(N-ethyl-3-methylanilino)acetamide
CID 109011313
3-amino-N-ethyl-N-(3-methylphenyl)propanamide
CID 22692119
3-N-ethyl-1-N-(2-fluorophenyl)-3-N-(3-methylphenyl)benzene-1,3-dicarboxamide
CID 109057447
2-bromo-N-ethyl-N-(3-methylphenyl)-5-sulfanylbenzamide
CID 107023751
5-amino-N-ethyl-2-methoxy-N-(3-methylphenyl)benzamide
CID 61104661
N-ethyl-N-(3-methylphenyl)-4-sulfanylbenzamide
CID 107023760
1-N,1-N,4-N-triethyl-4-N-(3-methylphenyl)benzene-1,4-dicarboxamide
CID 109048470
N-ethyl-N-(3-methylphenyl)carbamoyl chloride
CID 79001605

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-fluoro-2-hydrazinyl-N-(3-methylphenyl)benzamide?
The IUPAC name of N-ethyl-3-fluoro-2-hydrazinyl-N-(3-methylphenyl)benzamide (CID 62660273) is N-ethyl-3-fluoro-2-hydrazinyl-N-(3-methylphenyl)benzamide.
What is the SMILES notation for N-ethyl-3-fluoro-2-hydrazinyl-N-(3-methylphenyl)benzamide?
The canonical SMILES for N-ethyl-3-fluoro-2-hydrazinyl-N-(3-methylphenyl)benzamide is CCN(C(=O)c1cccc(F)c1NN)c1cccc(C)c1.
What is the InChIKey of N-ethyl-3-fluoro-2-hydrazinyl-N-(3-methylphenyl)benzamide?
The InChIKey is TXBSCADPUCVZNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18FN3O/c1-3-20(12-7-4-6-11(2)10-12)16(21)13-8-5-9-14(17)15(13)19-18/h4-10,19H,3,18H2,1-2H3.
What are the key properties of N-ethyl-3-fluoro-2-hydrazinyl-N-(3-methylphenyl)benzamide?
N-ethyl-3-fluoro-2-hydrazinyl-N-(3-methylphenyl)benzamide has a molecular weight of 287.34 g/mol, XLogP of 3.09, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-fluoro-2-hydrazinyl-N-(3-methylphenyl)benzamide is sourced from PubChem (CID 62660273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).