N'-(3-ethyl-4-oxoquinazolin-2-yl)-3,4-dimethylbenzohydrazide

C19H20N4O2 — CID 51251526

IUPACN'-(3-ethyl-4-oxoquinazolin-2-yl)-3,4-dimethylbenzohydrazide
SMILESCCn1c(NNC(=O)c2ccc(C)c(C)c2)nc2ccccc2c1=O
InChIInChI=1S/C19H20N4O2/c1-4-23-18(25)15-7-5-6-8-16(15)20-19(23)22-21-17(24)14-10-9-12(2)13(3)11-14/h5-11H,4H2,1-3H3,(H,20,22)(H,21,24)
InChIKeyCQQHBZLLUJFIPN-UHFFFAOYSA-N
MW336.40 g/mol
LogP2.79
Rot. Bonds4

About N'-(3-ethyl-4-oxoquinazolin-2-yl)-3,4-dimethylbenzohydrazide

N'-(3-ethyl-4-oxoquinazolin-2-yl)-3,4-dimethylbenzohydrazide (PubChem CID 51251526) has the molecular formula C19H20N4O2 and a molecular weight of 336.40 g/mol. Its IUPAC name is N'-(3-ethyl-4-oxoquinazolin-2-yl)-3,4-dimethylbenzohydrazide.

Molecular Properties

Compound NameN'-(3-ethyl-4-oxoquinazolin-2-yl)-3,4-dimethylbenzohydrazide
PubChem CID51251526
Molecular FormulaC19H20N4O2
Molecular Weight336.40 g/mol
Exact Mass336.16
IUPAC NameN'-(3-ethyl-4-oxoquinazolin-2-yl)-3,4-dimethylbenzohydrazide
SMILESCCn1c(NNC(=O)c2ccc(C)c(C)c2)nc2ccccc2c1=O
InChIInChI=1S/C19H20N4O2/c1-4-23-18(25)15-7-5-6-8-16(15)20-19(23)22-21-17(24)14-10-9-12(2)13(3)11-14/h5-11H,4H2,1-3H3,(H,20,22)(H,21,24)
InChIKeyCQQHBZLLUJFIPN-UHFFFAOYSA-N
XLogP2.79
TPSA76.02 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.40
LogP ≤ 52.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

5-[[(3-ethyl-4-oxoquinazolin-2-yl)amino]carbamoyl]-N,2,3-trimethylbenzenesulfonamide
CID 24598230
5-ethyl-N'-(3-ethyl-4-oxoquinazolin-2-yl)-4-methylthiophene-2-carbohydrazide
CID 18139295
N'-(3-ethyl-4-oxoquinazolin-2-yl)-6-methylpyridine-2-carbohydrazide
CID 134001910
N'-(3-ethyl-4-oxoquinazolin-2-yl)-2-phenylquinoline-4-carbohydrazide
CID 24598204
3-bromo-N'-(3-ethyl-4-oxoquinazolin-2-yl)-2-hydroxy-5-methylbenzohydrazide
CID 55940700
N'-(3-ethyl-4-oxoquinazolin-2-yl)-2-oxo-1H-quinoline-4-carbohydrazide
CID 18289419
N'-(3-ethyl-4-oxoquinazolin-2-yl)-1-methylindole-3-carbohydrazide
CID 46554469
5-bromo-N'-(3-ethyl-4-oxoquinazolin-2-yl)furan-2-carbohydrazide
CID 18139325
4-acetyl-N'-(3-ethyl-4-oxoquinazolin-2-yl)-3,5-dimethyl-1H-pyrrole-2-carbohydrazide
CID 18139314
2-cyclopentyl-N'-(3-ethyl-4-oxoquinazolin-2-yl)acetohydrazide
CID 18139328
2-ethoxy-N'-(3-ethyl-4-oxoquinazolin-2-yl)pyridine-3-carbohydrazide
CID 18139335
6-bromo-N'-(3-ethyl-4-oxoquinazolin-2-yl)-1H-indole-2-carbohydrazide
CID 46604334

Frequently Asked Questions

What is the IUPAC name of N'-(3-ethyl-4-oxoquinazolin-2-yl)-3,4-dimethylbenzohydrazide?
The IUPAC name of N'-(3-ethyl-4-oxoquinazolin-2-yl)-3,4-dimethylbenzohydrazide (CID 51251526) is N'-(3-ethyl-4-oxoquinazolin-2-yl)-3,4-dimethylbenzohydrazide.
What is the SMILES notation for N'-(3-ethyl-4-oxoquinazolin-2-yl)-3,4-dimethylbenzohydrazide?
The canonical SMILES for N'-(3-ethyl-4-oxoquinazolin-2-yl)-3,4-dimethylbenzohydrazide is CCn1c(NNC(=O)c2ccc(C)c(C)c2)nc2ccccc2c1=O.
What is the InChIKey of N'-(3-ethyl-4-oxoquinazolin-2-yl)-3,4-dimethylbenzohydrazide?
The InChIKey is CQQHBZLLUJFIPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O2/c1-4-23-18(25)15-7-5-6-8-16(15)20-19(23)22-21-17(24)14-10-9-12(2)13(3)11-14/h5-11H,4H2,1-3H3,(H,20,22)(H,21,24).
What are the key properties of N'-(3-ethyl-4-oxoquinazolin-2-yl)-3,4-dimethylbenzohydrazide?
N'-(3-ethyl-4-oxoquinazolin-2-yl)-3,4-dimethylbenzohydrazide has a molecular weight of 336.40 g/mol, XLogP of 2.79, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(3-ethyl-4-oxoquinazolin-2-yl)-3,4-dimethylbenzohydrazide is sourced from PubChem (CID 51251526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).