N'-(2-chloro-8-methylquinazolin-4-yl)-2-hydroxyacetohydrazide

C11H11ClN4O2 — CID 90258369

IUPACN'-(2-chloro-8-methylquinazolin-4-yl)-2-hydroxyacetohydrazide
SMILESCc1cccc2c(NNC(=O)CO)nc(Cl)nc12
InChIInChI=1S/C11H11ClN4O2/c1-6-3-2-4-7-9(6)13-11(12)14-10(7)16-15-8(18)5-17/h2-4,17H,5H2,1H3,(H,15,18)(H,13,14,16)
InChIKeyWTZFMKSUEPBREG-UHFFFAOYSA-N
MW266.69 g/mol
LogP1.03
Rot. Bonds3

About N'-(2-chloro-8-methylquinazolin-4-yl)-2-hydroxyacetohydrazide

N'-(2-chloro-8-methylquinazolin-4-yl)-2-hydroxyacetohydrazide (PubChem CID 90258369) has the molecular formula C11H11ClN4O2 and a molecular weight of 266.69 g/mol. Its IUPAC name is N'-(2-chloro-8-methylquinazolin-4-yl)-2-hydroxyacetohydrazide.

Molecular Properties

Compound NameN'-(2-chloro-8-methylquinazolin-4-yl)-2-hydroxyacetohydrazide
PubChem CID90258369
Molecular FormulaC11H11ClN4O2
Molecular Weight266.69 g/mol
Exact Mass266.06
IUPAC NameN'-(2-chloro-8-methylquinazolin-4-yl)-2-hydroxyacetohydrazide
SMILESCc1cccc2c(NNC(=O)CO)nc(Cl)nc12
InChIInChI=1S/C11H11ClN4O2/c1-6-3-2-4-7-9(6)13-11(12)14-10(7)16-15-8(18)5-17/h2-4,17H,5H2,1H3,(H,15,18)(H,13,14,16)
InChIKeyWTZFMKSUEPBREG-UHFFFAOYSA-N
XLogP1.03
TPSA87.14 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.69
LogP ≤ 51.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze N'-(2-chloro-8-methylquinazolin-4-yl)-2-hydroxyacetohydrazide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N'-(2-chloro-8-methylquinazolin-4-yl)-2-hydroxyacetohydrazide?
The IUPAC name of N'-(2-chloro-8-methylquinazolin-4-yl)-2-hydroxyacetohydrazide (CID 90258369) is N'-(2-chloro-8-methylquinazolin-4-yl)-2-hydroxyacetohydrazide.
What is the SMILES notation for N'-(2-chloro-8-methylquinazolin-4-yl)-2-hydroxyacetohydrazide?
The canonical SMILES for N'-(2-chloro-8-methylquinazolin-4-yl)-2-hydroxyacetohydrazide is Cc1cccc2c(NNC(=O)CO)nc(Cl)nc12.
What is the InChIKey of N'-(2-chloro-8-methylquinazolin-4-yl)-2-hydroxyacetohydrazide?
The InChIKey is WTZFMKSUEPBREG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11ClN4O2/c1-6-3-2-4-7-9(6)13-11(12)14-10(7)16-15-8(18)5-17/h2-4,17H,5H2,1H3,(H,15,18)(H,13,14,16).
What are the key properties of N'-(2-chloro-8-methylquinazolin-4-yl)-2-hydroxyacetohydrazide?
N'-(2-chloro-8-methylquinazolin-4-yl)-2-hydroxyacetohydrazide has a molecular weight of 266.69 g/mol, XLogP of 1.03, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-chloro-8-methylquinazolin-4-yl)-2-hydroxyacetohydrazide is sourced from PubChem (CID 90258369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).