3,4-dichloro-N-[2-oxo-2-[2-(pyridine-2-carbonyl)hydrazinyl]ethyl]benzamide

C15H12Cl2N4O3 — CID 9332038

IUPAC3,4-dichloro-N-[2-oxo-2-[2-(pyridine-2-carbonyl)hydrazinyl]ethyl]benzamide
SMILESO=C(CNC(=O)c1ccc(Cl)c(Cl)c1)NNC(=O)c1ccccn1
InChIInChI=1S/C15H12Cl2N4O3/c16-10-5-4-9(7-11(10)17)14(23)19-8-13(22)20-21-15(24)12-3-1-2-6-18-12/h1-7H,8H2,(H,19,23)(H,20,22)(H,21,24)
InChIKeyLDKPSBMBKQJRAG-UHFFFAOYSA-N
MW367.19 g/mol
LogP1.58
Rot. Bonds4

About 3,4-dichloro-N-[2-oxo-2-[2-(pyridine-2-carbonyl)hydrazinyl]ethyl]benzamide

3,4-dichloro-N-[2-oxo-2-[2-(pyridine-2-carbonyl)hydrazinyl]ethyl]benzamide (PubChem CID 9332038) has the molecular formula C15H12Cl2N4O3 and a molecular weight of 367.19 g/mol. Its IUPAC name is 3,4-dichloro-N-[2-oxo-2-[2-(pyridine-2-carbonyl)hydrazinyl]ethyl]benzamide.

Molecular Properties

Compound Name3,4-dichloro-N-[2-oxo-2-[2-(pyridine-2-carbonyl)hydrazinyl]ethyl]benzamide
PubChem CID9332038
Molecular FormulaC15H12Cl2N4O3
Molecular Weight367.19 g/mol
Exact Mass366.03
IUPAC Name3,4-dichloro-N-[2-oxo-2-[2-(pyridine-2-carbonyl)hydrazinyl]ethyl]benzamide
SMILESO=C(CNC(=O)c1ccc(Cl)c(Cl)c1)NNC(=O)c1ccccn1
InChIInChI=1S/C15H12Cl2N4O3/c16-10-5-4-9(7-11(10)17)14(23)19-8-13(22)20-21-15(24)12-3-1-2-6-18-12/h1-7H,8H2,(H,19,23)(H,20,22)(H,21,24)
InChIKeyLDKPSBMBKQJRAG-UHFFFAOYSA-N
XLogP1.58
TPSA100.19 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.19
LogP ≤ 51.58
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[2-oxo-2-[2-(pyridine-2-carbonyl)hydrazinyl]ethyl]-4-phenoxybenzamide
CID 9333080
3-nitro-N-[2-oxo-2-[2-(pyridine-2-carbonyl)hydrazinyl]ethyl]benzamide
CID 27662135
N-[2-(benzylamino)-2-oxoethyl]-3,4-dichlorobenzamide
CID 9336870
3,4-dichloro-N-[2-(2,6-dichloroanilino)-2-oxoethyl]benzamide
CID 113001415
4-bromo-N-[3-oxo-3-[2-(pyridine-2-carbonyl)hydrazinyl]propyl]benzamide
CID 4789969
N-[2-[(2-amino-2-oxoethyl)amino]-2-oxoethyl]-3,4-dichlorobenzamide
CID 9295430
3,4-dichloro-N-(3-pyridin-2-ylpropyl)benzamide
CID 110660973
3,4-dichloro-N-(1-pyridin-2-ylethylideneamino)benzamide
CID 773914
3,4-dichloro-N-[[4-(pyridin-2-ylmethoxy)phenyl]methyl]benzamide
CID 60534147
3,4-dichloro-N-[2-oxo-2-(pyridin-3-ylamino)ethyl]benzamide
CID 26592239
N-[2-(2-benzoylhydrazinyl)-2-oxoethyl]-4-chlorobenzamide
CID 9414874
4-chloro-N-[2-[2-(4-methylbenzoyl)hydrazinyl]-2-oxoethyl]pyridine-2-carboxamide
CID 9366395

Frequently Asked Questions

What is the IUPAC name of 3,4-dichloro-N-[2-oxo-2-[2-(pyridine-2-carbonyl)hydrazinyl]ethyl]benzamide?
The IUPAC name of 3,4-dichloro-N-[2-oxo-2-[2-(pyridine-2-carbonyl)hydrazinyl]ethyl]benzamide (CID 9332038) is 3,4-dichloro-N-[2-oxo-2-[2-(pyridine-2-carbonyl)hydrazinyl]ethyl]benzamide.
What is the SMILES notation for 3,4-dichloro-N-[2-oxo-2-[2-(pyridine-2-carbonyl)hydrazinyl]ethyl]benzamide?
The canonical SMILES for 3,4-dichloro-N-[2-oxo-2-[2-(pyridine-2-carbonyl)hydrazinyl]ethyl]benzamide is O=C(CNC(=O)c1ccc(Cl)c(Cl)c1)NNC(=O)c1ccccn1.
What is the InChIKey of 3,4-dichloro-N-[2-oxo-2-[2-(pyridine-2-carbonyl)hydrazinyl]ethyl]benzamide?
The InChIKey is LDKPSBMBKQJRAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12Cl2N4O3/c16-10-5-4-9(7-11(10)17)14(23)19-8-13(22)20-21-15(24)12-3-1-2-6-18-12/h1-7H,8H2,(H,19,23)(H,20,22)(H,21,24).
What are the key properties of 3,4-dichloro-N-[2-oxo-2-[2-(pyridine-2-carbonyl)hydrazinyl]ethyl]benzamide?
3,4-dichloro-N-[2-oxo-2-[2-(pyridine-2-carbonyl)hydrazinyl]ethyl]benzamide has a molecular weight of 367.19 g/mol, XLogP of 1.58, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dichloro-N-[2-oxo-2-[2-(pyridine-2-carbonyl)hydrazinyl]ethyl]benzamide is sourced from PubChem (CID 9332038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).