(3-chloro-2-methylpyrazolo[1,5-a]quinazolin-5-yl)hydrazine

C11H10ClN5 — CID 60919533

IUPAC(3-chloro-2-methylpyrazolo[1,5-a]quinazolin-5-yl)hydrazine
SMILESCc1nn2c(nc(NN)c3ccccc32)c1Cl
InChIInChI=1S/C11H10ClN5/c1-6-9(12)11-14-10(15-13)7-4-2-3-5-8(7)17(11)16-6/h2-5H,13H2,1H3,(H,14,15)
InChIKeyWUWRXNGGXQICPN-UHFFFAOYSA-N
MW247.69 g/mol
LogP2.13
Rot. Bonds1

About (3-chloro-2-methylpyrazolo[1,5-a]quinazolin-5-yl)hydrazine

(3-chloro-2-methylpyrazolo[1,5-a]quinazolin-5-yl)hydrazine (PubChem CID 60919533) has the molecular formula C11H10ClN5 and a molecular weight of 247.69 g/mol. Its IUPAC name is (3-chloro-2-methylpyrazolo[1,5-a]quinazolin-5-yl)hydrazine.

Molecular Properties

Compound Name(3-chloro-2-methylpyrazolo[1,5-a]quinazolin-5-yl)hydrazine
PubChem CID60919533
Molecular FormulaC11H10ClN5
Molecular Weight247.69 g/mol
Exact Mass247.06
IUPAC Name(3-chloro-2-methylpyrazolo[1,5-a]quinazolin-5-yl)hydrazine
SMILESCc1nn2c(nc(NN)c3ccccc32)c1Cl
InChIInChI=1S/C11H10ClN5/c1-6-9(12)11-14-10(15-13)7-4-2-3-5-8(7)17(11)16-6/h2-5H,13H2,1H3,(H,14,15)
InChIKeyWUWRXNGGXQICPN-UHFFFAOYSA-N
XLogP2.13
TPSA68.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.69
LogP ≤ 52.13
H-Bond Donors ≤ 52
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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Frequently Asked Questions

What is the IUPAC name of (3-chloro-2-methylpyrazolo[1,5-a]quinazolin-5-yl)hydrazine?
The IUPAC name of (3-chloro-2-methylpyrazolo[1,5-a]quinazolin-5-yl)hydrazine (CID 60919533) is (3-chloro-2-methylpyrazolo[1,5-a]quinazolin-5-yl)hydrazine.
What is the SMILES notation for (3-chloro-2-methylpyrazolo[1,5-a]quinazolin-5-yl)hydrazine?
The canonical SMILES for (3-chloro-2-methylpyrazolo[1,5-a]quinazolin-5-yl)hydrazine is Cc1nn2c(nc(NN)c3ccccc32)c1Cl.
What is the InChIKey of (3-chloro-2-methylpyrazolo[1,5-a]quinazolin-5-yl)hydrazine?
The InChIKey is WUWRXNGGXQICPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10ClN5/c1-6-9(12)11-14-10(15-13)7-4-2-3-5-8(7)17(11)16-6/h2-5H,13H2,1H3,(H,14,15).
What are the key properties of (3-chloro-2-methylpyrazolo[1,5-a]quinazolin-5-yl)hydrazine?
(3-chloro-2-methylpyrazolo[1,5-a]quinazolin-5-yl)hydrazine has a molecular weight of 247.69 g/mol, XLogP of 2.13, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3-chloro-2-methylpyrazolo[1,5-a]quinazolin-5-yl)hydrazine is sourced from PubChem (CID 60919533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).