3-amino-N'-(4-pyridin-4-ylbenzoyl)benzohydrazide

C19H16N4O2 — CID 143062088

IUPAC3-amino-N'-(4-pyridin-4-ylbenzoyl)benzohydrazide
SMILESNc1cccc(C(=O)NNC(=O)c2ccc(-c3ccncc3)cc2)c1
InChIInChI=1S/C19H16N4O2/c20-17-3-1-2-16(12-17)19(25)23-22-18(24)15-6-4-13(5-7-15)14-8-10-21-11-9-14/h1-12H,20H2,(H,22,24)(H,23,25)
InChIKeyZXVHQYUFOKVNSN-UHFFFAOYSA-N
MW332.36 g/mol
LogP2.41
Rot. Bonds3

About 3-amino-N'-(4-pyridin-4-ylbenzoyl)benzohydrazide

3-amino-N'-(4-pyridin-4-ylbenzoyl)benzohydrazide (PubChem CID 143062088) has the molecular formula C19H16N4O2 and a molecular weight of 332.36 g/mol. Its IUPAC name is 3-amino-N'-(4-pyridin-4-ylbenzoyl)benzohydrazide.

Molecular Properties

Compound Name3-amino-N'-(4-pyridin-4-ylbenzoyl)benzohydrazide
PubChem CID143062088
Molecular FormulaC19H16N4O2
Molecular Weight332.36 g/mol
Exact Mass332.13
IUPAC Name3-amino-N'-(4-pyridin-4-ylbenzoyl)benzohydrazide
SMILESNc1cccc(C(=O)NNC(=O)c2ccc(-c3ccncc3)cc2)c1
InChIInChI=1S/C19H16N4O2/c20-17-3-1-2-16(12-17)19(25)23-22-18(24)15-6-4-13(5-7-15)14-8-10-21-11-9-14/h1-12H,20H2,(H,22,24)(H,23,25)
InChIKeyZXVHQYUFOKVNSN-UHFFFAOYSA-N
XLogP2.41
TPSA97.11 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.36
LogP ≤ 52.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N'-(4-chlorobenzoyl)-4-pyridin-4-ylbenzohydrazide
CID 58858336
N'-(3-iodobenzoyl)pyridine-4-carbohydrazide
CID 3280219
3-amino-N-[3-[(4-aminobenzoyl)amino]phenyl]benzamide
CID 121331562
N-[(3-aminobenzoyl)amino]formamide
CID 142270401
3-amino-N-(4-phenylphenyl)benzamide
CID 757806
N'-(4-methylbenzoyl)pyridine-4-carbohydrazide
CID 788109
3-methyl-N'-(4-phenylbenzoyl)benzohydrazide
CID 828309
3-iodo-N'-(4-phenylbenzoyl)benzohydrazide
CID 1035001
3-chloro-N'-(4-pyridin-4-yloxybenzoyl)benzohydrazide
CID 11349148
1-N,4-N-bis(4-pyridin-4-ylphenyl)benzene-1,4-dicarboxamide
CID 171423296
3-[[(4-carbamoylbenzoyl)amino]carbamoyl]benzamide
CID 139830477
N-(3-pyridin-4-ylphenyl)pyridine-4-carboxamide
CID 166320523

Frequently Asked Questions

What is the IUPAC name of 3-amino-N'-(4-pyridin-4-ylbenzoyl)benzohydrazide?
The IUPAC name of 3-amino-N'-(4-pyridin-4-ylbenzoyl)benzohydrazide (CID 143062088) is 3-amino-N'-(4-pyridin-4-ylbenzoyl)benzohydrazide.
What is the SMILES notation for 3-amino-N'-(4-pyridin-4-ylbenzoyl)benzohydrazide?
The canonical SMILES for 3-amino-N'-(4-pyridin-4-ylbenzoyl)benzohydrazide is Nc1cccc(C(=O)NNC(=O)c2ccc(-c3ccncc3)cc2)c1.
What is the InChIKey of 3-amino-N'-(4-pyridin-4-ylbenzoyl)benzohydrazide?
The InChIKey is ZXVHQYUFOKVNSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N4O2/c20-17-3-1-2-16(12-17)19(25)23-22-18(24)15-6-4-13(5-7-15)14-8-10-21-11-9-14/h1-12H,20H2,(H,22,24)(H,23,25).
What are the key properties of 3-amino-N'-(4-pyridin-4-ylbenzoyl)benzohydrazide?
3-amino-N'-(4-pyridin-4-ylbenzoyl)benzohydrazide has a molecular weight of 332.36 g/mol, XLogP of 2.41, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N'-(4-pyridin-4-ylbenzoyl)benzohydrazide is sourced from PubChem (CID 143062088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).