N-cyclopropyl-2-hydrazinylquinazolin-4-amine

C11H13N5 — CID 80932837

IUPACN-cyclopropyl-2-hydrazinylquinazolin-4-amine
SMILESNNc1nc(NC2CC2)c2ccccc2n1
InChIInChI=1S/C11H13N5/c12-16-11-14-9-4-2-1-3-8(9)10(15-11)13-7-5-6-7/h1-4,7H,5-6,12H2,(H2,13,14,15,16)
InChIKeyHCFLQAXTMMZYMS-UHFFFAOYSA-N
MW215.26 g/mol
LogP1.49
Rot. Bonds3

About N-cyclopropyl-2-hydrazinylquinazolin-4-amine

N-cyclopropyl-2-hydrazinylquinazolin-4-amine (PubChem CID 80932837) has the molecular formula C11H13N5 and a molecular weight of 215.26 g/mol. Its IUPAC name is N-cyclopropyl-2-hydrazinylquinazolin-4-amine.

Molecular Properties

Compound NameN-cyclopropyl-2-hydrazinylquinazolin-4-amine
PubChem CID80932837
Molecular FormulaC11H13N5
Molecular Weight215.26 g/mol
Exact Mass215.12
IUPAC NameN-cyclopropyl-2-hydrazinylquinazolin-4-amine
SMILESNNc1nc(NC2CC2)c2ccccc2n1
InChIInChI=1S/C11H13N5/c12-16-11-14-9-4-2-1-3-8(9)10(15-11)13-7-5-6-7/h1-4,7H,5-6,12H2,(H2,13,14,15,16)
InChIKeyHCFLQAXTMMZYMS-UHFFFAOYSA-N
XLogP1.49
TPSA75.86 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.26
LogP ≤ 51.49
H-Bond Donors ≤ 53
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 N-cyclopropyl-2-hydrazinylquinazolin-4-amine?
The IUPAC name of N-cyclopropyl-2-hydrazinylquinazolin-4-amine (CID 80932837) is N-cyclopropyl-2-hydrazinylquinazolin-4-amine.
What is the SMILES notation for N-cyclopropyl-2-hydrazinylquinazolin-4-amine?
The canonical SMILES for N-cyclopropyl-2-hydrazinylquinazolin-4-amine is NNc1nc(NC2CC2)c2ccccc2n1.
What is the InChIKey of N-cyclopropyl-2-hydrazinylquinazolin-4-amine?
The InChIKey is HCFLQAXTMMZYMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N5/c12-16-11-14-9-4-2-1-3-8(9)10(15-11)13-7-5-6-7/h1-4,7H,5-6,12H2,(H2,13,14,15,16).
What are the key properties of N-cyclopropyl-2-hydrazinylquinazolin-4-amine?
N-cyclopropyl-2-hydrazinylquinazolin-4-amine has a molecular weight of 215.26 g/mol, XLogP of 1.49, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-hydrazinylquinazolin-4-amine is sourced from PubChem (CID 80932837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).