3-chloro-N'-(2,2-diphenylacetyl)benzohydrazide

C21H17ClN2O2 — CID 1378804

IUPAC3-chloro-N'-(2,2-diphenylacetyl)benzohydrazide
SMILESO=C(NNC(=O)C(c1ccccc1)c1ccccc1)c1cccc(Cl)c1
InChIInChI=1S/C21H17ClN2O2/c22-18-13-7-12-17(14-18)20(25)23-24-21(26)19(15-8-3-1-4-9-15)16-10-5-2-6-11-16/h1-14,19H,(H,23,25)(H,24,26)
InChIKeyKOTCOPMZIOXJCI-UHFFFAOYSA-N
MW364.83 g/mol
LogP3.93
Rot. Bonds4

About 3-chloro-N'-(2,2-diphenylacetyl)benzohydrazide

3-chloro-N'-(2,2-diphenylacetyl)benzohydrazide (PubChem CID 1378804) has the molecular formula C21H17ClN2O2 and a molecular weight of 364.83 g/mol. Its IUPAC name is 3-chloro-N'-(2,2-diphenylacetyl)benzohydrazide.

Molecular Properties

Compound Name3-chloro-N'-(2,2-diphenylacetyl)benzohydrazide
PubChem CID1378804
Molecular FormulaC21H17ClN2O2
Molecular Weight364.83 g/mol
Exact Mass364.10
IUPAC Name3-chloro-N'-(2,2-diphenylacetyl)benzohydrazide
SMILESO=C(NNC(=O)C(c1ccccc1)c1ccccc1)c1cccc(Cl)c1
InChIInChI=1S/C21H17ClN2O2/c22-18-13-7-12-17(14-18)20(25)23-24-21(26)19(15-8-3-1-4-9-15)16-10-5-2-6-11-16/h1-14,19H,(H,23,25)(H,24,26)
InChIKeyKOTCOPMZIOXJCI-UHFFFAOYSA-N
XLogP3.93
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.83
LogP ≤ 53.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-chloro-N'-[(2R)-2-chloropropanoyl]benzohydrazide
CID 25323385
4-tert-butyl-N'-(2,2-diphenylacetyl)benzohydrazide
CID 3260570
3-chloro-N-[4-[(2,2-diphenylacetyl)amino]-2-methoxyphenyl]benzamide
CID 156773698
3-chloro-N-[(1R,2R)-1-hydroxy-1-phenylpropan-2-yl]benzamide
CID 40648027
N-[4-[[(3-chlorobenzoyl)amino]carbamoyl]phenyl]-2-methylpropanamide
CID 4940345
3-chloro-N'-[(Z)-3-phenylprop-2-enoyl]benzohydrazide
CID 2166903
N'-(3-chlorobenzoyl)-3,4-dimethylbenzohydrazide
CID 7918365
3-chloro-N'-[2-(4-phenylphenyl)acetyl]benzohydrazide
CID 1367057
3-chloro-N'-[(2S)-2-(5-phenyltetrazol-2-yl)propanoyl]benzohydrazide
CID 95781242
N'-(2,2-diphenylacetyl)-3-methoxy-4-propan-2-yloxybenzohydrazide
CID 7972036
3-chloro-N-[3-[(3-chlorobenzoyl)amino]phenyl]benzamide
CID 1369981
N'-tert-butyl-3-chlorobenzohydrazide
CID 15617772

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N'-(2,2-diphenylacetyl)benzohydrazide?
The IUPAC name of 3-chloro-N'-(2,2-diphenylacetyl)benzohydrazide (CID 1378804) is 3-chloro-N'-(2,2-diphenylacetyl)benzohydrazide.
What is the SMILES notation for 3-chloro-N'-(2,2-diphenylacetyl)benzohydrazide?
The canonical SMILES for 3-chloro-N'-(2,2-diphenylacetyl)benzohydrazide is O=C(NNC(=O)C(c1ccccc1)c1ccccc1)c1cccc(Cl)c1.
What is the InChIKey of 3-chloro-N'-(2,2-diphenylacetyl)benzohydrazide?
The InChIKey is KOTCOPMZIOXJCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17ClN2O2/c22-18-13-7-12-17(14-18)20(25)23-24-21(26)19(15-8-3-1-4-9-15)16-10-5-2-6-11-16/h1-14,19H,(H,23,25)(H,24,26).
What are the key properties of 3-chloro-N'-(2,2-diphenylacetyl)benzohydrazide?
3-chloro-N'-(2,2-diphenylacetyl)benzohydrazide has a molecular weight of 364.83 g/mol, XLogP of 3.93, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N'-(2,2-diphenylacetyl)benzohydrazide is sourced from PubChem (CID 1378804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).