4-hydrazinyl-N-[2-(4-oxo-3H-quinazolin-2-yl)phenyl]benzamide

C21H17N5O2 — CID 135794633

IUPAC4-hydrazinyl-N-[2-(4-oxo-3H-quinazolin-2-yl)phenyl]benzamide
SMILESNNc1ccc(C(=O)Nc2ccccc2-c2nc3ccccc3c(=O)[nH]2)cc1
InChIInChI=1S/C21H17N5O2/c22-26-14-11-9-13(10-12-14)20(27)24-17-7-3-1-5-15(17)19-23-18-8-4-2-6-16(18)21(28)25-19/h1-12,26H,22H2,(H,24,27)(H,23,25,28)
InChIKeyHGBPWEIEUFAHRM-UHFFFAOYSA-N
MW371.40 g/mol
LogP3.13
Rot. Bonds4

About 4-hydrazinyl-N-[2-(4-oxo-3H-quinazolin-2-yl)phenyl]benzamide

4-hydrazinyl-N-[2-(4-oxo-3H-quinazolin-2-yl)phenyl]benzamide (PubChem CID 135794633) has the molecular formula C21H17N5O2 and a molecular weight of 371.40 g/mol. Its IUPAC name is 4-hydrazinyl-N-[2-(4-oxo-3H-quinazolin-2-yl)phenyl]benzamide.

Molecular Properties

Compound Name4-hydrazinyl-N-[2-(4-oxo-3H-quinazolin-2-yl)phenyl]benzamide
PubChem CID135794633
Molecular FormulaC21H17N5O2
Molecular Weight371.40 g/mol
Exact Mass371.14
IUPAC Name4-hydrazinyl-N-[2-(4-oxo-3H-quinazolin-2-yl)phenyl]benzamide
SMILESNNc1ccc(C(=O)Nc2ccccc2-c2nc3ccccc3c(=O)[nH]2)cc1
InChIInChI=1S/C21H17N5O2/c22-26-14-11-9-13(10-12-14)20(27)24-17-7-3-1-5-15(17)19-23-18-8-4-2-6-16(18)21(28)25-19/h1-12,26H,22H2,(H,24,27)(H,23,25,28)
InChIKeyHGBPWEIEUFAHRM-UHFFFAOYSA-N
XLogP3.13
TPSA112.90 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.40
LogP ≤ 53.13
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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

4-chloro-N-[2-(4-oxo-3H-quinazolin-2-yl)phenyl]benzamide
CID 135995875
4-nitro-N-[2-(4-oxo-3H-quinazolin-2-yl)phenyl]benzamide
CID 136739934
4-chloro-N-[4-(4-oxo-3H-quinazolin-2-yl)phenyl]benzamide
CID 164517199
4-hydroxy-3-(4-oxo-3H-quinazolin-2-yl)benzohydrazide
CID 135794634
2-amino-N-[2-(1H-benzimidazol-2-yl)phenyl]quinazoline-4-carboxamide
CID 59483498
2-amino-3-(4-oxo-3H-quinazolin-2-yl)benzoic acid
CID 162513899
N-[2-(1H-benzimidazol-2-yl)phenyl]-4-cyanobenzamide
CID 739930
2-(4-oxo-3H-quinazolin-2-yl)-3H-quinazolin-4-one
CID 135465251
2-naphthalen-1-yl-3H-quinazolin-4-one
CID 135437423
N-[2-(1H-benzimidazol-2-yl)phenyl]-4-(ethylsulfanylmethyl)benzamide
CID 60527286
N-[2-(1H-benzimidazol-2-yl)phenyl]pyridine-3-carboxamide
CID 23826035
N-(4-methylphenyl)-2-[2-(4-oxo-3H-quinazolin-2-yl)phenoxy]acetamide
CID 168552578

Frequently Asked Questions

What is the IUPAC name of 4-hydrazinyl-N-[2-(4-oxo-3H-quinazolin-2-yl)phenyl]benzamide?
The IUPAC name of 4-hydrazinyl-N-[2-(4-oxo-3H-quinazolin-2-yl)phenyl]benzamide (CID 135794633) is 4-hydrazinyl-N-[2-(4-oxo-3H-quinazolin-2-yl)phenyl]benzamide.
What is the SMILES notation for 4-hydrazinyl-N-[2-(4-oxo-3H-quinazolin-2-yl)phenyl]benzamide?
The canonical SMILES for 4-hydrazinyl-N-[2-(4-oxo-3H-quinazolin-2-yl)phenyl]benzamide is NNc1ccc(C(=O)Nc2ccccc2-c2nc3ccccc3c(=O)[nH]2)cc1.
What is the InChIKey of 4-hydrazinyl-N-[2-(4-oxo-3H-quinazolin-2-yl)phenyl]benzamide?
The InChIKey is HGBPWEIEUFAHRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17N5O2/c22-26-14-11-9-13(10-12-14)20(27)24-17-7-3-1-5-15(17)19-23-18-8-4-2-6-16(18)21(28)25-19/h1-12,26H,22H2,(H,24,27)(H,23,25,28).
What are the key properties of 4-hydrazinyl-N-[2-(4-oxo-3H-quinazolin-2-yl)phenyl]benzamide?
4-hydrazinyl-N-[2-(4-oxo-3H-quinazolin-2-yl)phenyl]benzamide has a molecular weight of 371.40 g/mol, XLogP of 3.13, 4 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydrazinyl-N-[2-(4-oxo-3H-quinazolin-2-yl)phenyl]benzamide is sourced from PubChem (CID 135794633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).