3,5-difluoro-N'-methyl-N'-phenylbenzohydrazide

C14H12F2N2O — CID 9479852

IUPAC3,5-difluoro-N'-methyl-N'-phenylbenzohydrazide
SMILESCN(NC(=O)c1cc(F)cc(F)c1)c1ccccc1
InChIInChI=1S/C14H12F2N2O/c1-18(13-5-3-2-4-6-13)17-14(19)10-7-11(15)9-12(16)8-10/h2-9H,1H3,(H,17,19)
InChIKeyMNBDJHSNUOLAFE-UHFFFAOYSA-N
MW262.26 g/mol
LogP2.75
Rot. Bonds3

About 3,5-difluoro-N'-methyl-N'-phenylbenzohydrazide

3,5-difluoro-N'-methyl-N'-phenylbenzohydrazide (PubChem CID 9479852) has the molecular formula C14H12F2N2O and a molecular weight of 262.26 g/mol. Its IUPAC name is 3,5-difluoro-N'-methyl-N'-phenylbenzohydrazide.

Molecular Properties

Compound Name3,5-difluoro-N'-methyl-N'-phenylbenzohydrazide
PubChem CID9479852
Molecular FormulaC14H12F2N2O
Molecular Weight262.26 g/mol
Exact Mass262.09
IUPAC Name3,5-difluoro-N'-methyl-N'-phenylbenzohydrazide
SMILESCN(NC(=O)c1cc(F)cc(F)c1)c1ccccc1
InChIInChI=1S/C14H12F2N2O/c1-18(13-5-3-2-4-6-13)17-14(19)10-7-11(15)9-12(16)8-10/h2-9H,1H3,(H,17,19)
InChIKeyMNBDJHSNUOLAFE-UHFFFAOYSA-N
XLogP2.75
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.26
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-tert-butyl-N'-methyl-N'-phenylbenzohydrazide
CID 9479496
7-chloro-N'-methyl-N'-phenyl-1,3-benzodioxole-5-carbohydrazide
CID 9480093
N'-methyl-4-(methylsulfanylmethyl)-N'-phenylbenzohydrazide
CID 9479963
3-fluoro-5-(N-methylanilino)benzoic acid
CID 82537620
N-[(2R)-2-(dimethylamino)-2-phenylethyl]-3,5-difluorobenzamide
CID 7897282
N'-methyl-N'-phenyl-4-pyrrolidin-1-ylsulfonylbenzohydrazide
CID 9479606
4-methoxy-N'-methyl-3-nitro-N'-phenylbenzohydrazide
CID 17432301
2-(2,5-difluorophenyl)sulfanyl-N'-methyl-N'-phenylacetohydrazide
CID 9480197
3-methoxy-N'-methyl-N'-phenylnaphthalene-2-carbohydrazide
CID 9479564
N-[4-[(N-methylanilino)carbamoyl]phenyl]thiophene-2-carboxamide
CID 9480193
2-(N-(3,5-difluorobenzoyl)anilino)acetic acid
CID 60832677
3,5-difluoro-N-(2-hydroxyphenyl)benzamide
CID 17396762

Frequently Asked Questions

What is the IUPAC name of 3,5-difluoro-N'-methyl-N'-phenylbenzohydrazide?
The IUPAC name of 3,5-difluoro-N'-methyl-N'-phenylbenzohydrazide (CID 9479852) is 3,5-difluoro-N'-methyl-N'-phenylbenzohydrazide.
What is the SMILES notation for 3,5-difluoro-N'-methyl-N'-phenylbenzohydrazide?
The canonical SMILES for 3,5-difluoro-N'-methyl-N'-phenylbenzohydrazide is CN(NC(=O)c1cc(F)cc(F)c1)c1ccccc1.
What is the InChIKey of 3,5-difluoro-N'-methyl-N'-phenylbenzohydrazide?
The InChIKey is MNBDJHSNUOLAFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12F2N2O/c1-18(13-5-3-2-4-6-13)17-14(19)10-7-11(15)9-12(16)8-10/h2-9H,1H3,(H,17,19).
What are the key properties of 3,5-difluoro-N'-methyl-N'-phenylbenzohydrazide?
3,5-difluoro-N'-methyl-N'-phenylbenzohydrazide has a molecular weight of 262.26 g/mol, XLogP of 2.75, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-difluoro-N'-methyl-N'-phenylbenzohydrazide is sourced from PubChem (CID 9479852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).