5-chloro-2-hydrazinyl-N-(3-methylphenyl)benzamide

C14H14ClN3O — CID 62236027

IUPAC5-chloro-2-hydrazinyl-N-(3-methylphenyl)benzamide
SMILESCc1cccc(NC(=O)c2cc(Cl)ccc2NN)c1
InChIInChI=1S/C14H14ClN3O/c1-9-3-2-4-11(7-9)17-14(19)12-8-10(15)5-6-13(12)18-16/h2-8,18H,16H2,1H3,(H,17,19)
InChIKeySKCRSGWSVPNZLH-UHFFFAOYSA-N
MW275.74 g/mol
LogP3.19
Rot. Bonds3

About 5-chloro-2-hydrazinyl-N-(3-methylphenyl)benzamide

5-chloro-2-hydrazinyl-N-(3-methylphenyl)benzamide (PubChem CID 62236027) has the molecular formula C14H14ClN3O and a molecular weight of 275.74 g/mol. Its IUPAC name is 5-chloro-2-hydrazinyl-N-(3-methylphenyl)benzamide.

Molecular Properties

Compound Name5-chloro-2-hydrazinyl-N-(3-methylphenyl)benzamide
PubChem CID62236027
Molecular FormulaC14H14ClN3O
Molecular Weight275.74 g/mol
Exact Mass275.08
IUPAC Name5-chloro-2-hydrazinyl-N-(3-methylphenyl)benzamide
SMILESCc1cccc(NC(=O)c2cc(Cl)ccc2NN)c1
InChIInChI=1S/C14H14ClN3O/c1-9-3-2-4-11(7-9)17-14(19)12-8-10(15)5-6-13(12)18-16/h2-8,18H,16H2,1H3,(H,17,19)
InChIKeySKCRSGWSVPNZLH-UHFFFAOYSA-N
XLogP3.19
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.74
LogP ≤ 53.19
H-Bond Donors ≤ 53
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

5-chloro-N-(3-chlorophenyl)-2-hydrazinylbenzamide
CID 55052324
5-chloro-2-(methanesulfonamido)-N-(3-methylphenyl)benzamide
CID 49191937
5-chloro-N-(2,3-dimethylphenyl)-2-hydrazinylbenzamide
CID 62241246
5-chloro-2-hydrazinyl-N-(4-propan-2-ylphenyl)benzamide
CID 62238383
5-chloro-N-(3,5-dimethylphenyl)-2-(methylamino)benzamide
CID 62165706
5-chloro-2-hydrazinyl-N-(3,4,5-trifluorophenyl)benzamide
CID 62812110
3-chloro-N-(3-methylphenyl)benzamide
CID 722373
2,5-dimethyl-N-(3-methylphenyl)benzamide
CID 925357
2-[(2-chlorobenzoyl)amino]-N-(3-methylphenyl)benzamide
CID 29448368
3,6-dichloro-N-(3-methylphenyl)pyridazine-4-carboxamide
CID 13456213
5-chloro-N-(5-chloro-2-fluorophenyl)-2-hydrazinylbenzamide
CID 62242667
2,5-dichloro-N-(3,5-dimethylphenyl)benzamide
CID 965625

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-hydrazinyl-N-(3-methylphenyl)benzamide?
The IUPAC name of 5-chloro-2-hydrazinyl-N-(3-methylphenyl)benzamide (CID 62236027) is 5-chloro-2-hydrazinyl-N-(3-methylphenyl)benzamide.
What is the SMILES notation for 5-chloro-2-hydrazinyl-N-(3-methylphenyl)benzamide?
The canonical SMILES for 5-chloro-2-hydrazinyl-N-(3-methylphenyl)benzamide is Cc1cccc(NC(=O)c2cc(Cl)ccc2NN)c1.
What is the InChIKey of 5-chloro-2-hydrazinyl-N-(3-methylphenyl)benzamide?
The InChIKey is SKCRSGWSVPNZLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClN3O/c1-9-3-2-4-11(7-9)17-14(19)12-8-10(15)5-6-13(12)18-16/h2-8,18H,16H2,1H3,(H,17,19).
What are the key properties of 5-chloro-2-hydrazinyl-N-(3-methylphenyl)benzamide?
5-chloro-2-hydrazinyl-N-(3-methylphenyl)benzamide has a molecular weight of 275.74 g/mol, XLogP of 3.19, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-hydrazinyl-N-(3-methylphenyl)benzamide is sourced from PubChem (CID 62236027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).