N-(2-cyclobutylethyl)-2-hydrazinylquinazolin-4-amine

C14H19N5 — CID 113479557

IUPACN-(2-cyclobutylethyl)-2-hydrazinylquinazolin-4-amine
SMILESNNc1nc(NCCC2CCC2)c2ccccc2n1
InChIInChI=1S/C14H19N5/c15-19-14-17-12-7-2-1-6-11(12)13(18-14)16-9-8-10-4-3-5-10/h1-2,6-7,10H,3-5,8-9,15H2,(H2,16,17,18,19)
InChIKeyHYGLSVDZPCZYEC-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.52
Rot. Bonds5

About N-(2-cyclobutylethyl)-2-hydrazinylquinazolin-4-amine

N-(2-cyclobutylethyl)-2-hydrazinylquinazolin-4-amine (PubChem CID 113479557) has the molecular formula C14H19N5 and a molecular weight of 257.34 g/mol. Its IUPAC name is N-(2-cyclobutylethyl)-2-hydrazinylquinazolin-4-amine.

Molecular Properties

Compound NameN-(2-cyclobutylethyl)-2-hydrazinylquinazolin-4-amine
PubChem CID113479557
Molecular FormulaC14H19N5
Molecular Weight257.34 g/mol
Exact Mass257.16
IUPAC NameN-(2-cyclobutylethyl)-2-hydrazinylquinazolin-4-amine
SMILESNNc1nc(NCCC2CCC2)c2ccccc2n1
InChIInChI=1S/C14H19N5/c15-19-14-17-12-7-2-1-6-11(12)13(18-14)16-9-8-10-4-3-5-10/h1-2,6-7,10H,3-5,8-9,15H2,(H2,16,17,18,19)
InChIKeyHYGLSVDZPCZYEC-UHFFFAOYSA-N
XLogP2.52
TPSA75.86 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.52
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-(2-cyclobutylethyl)-2-hydrazinylquinazolin-4-amine?
The IUPAC name of N-(2-cyclobutylethyl)-2-hydrazinylquinazolin-4-amine (CID 113479557) is N-(2-cyclobutylethyl)-2-hydrazinylquinazolin-4-amine.
What is the SMILES notation for N-(2-cyclobutylethyl)-2-hydrazinylquinazolin-4-amine?
The canonical SMILES for N-(2-cyclobutylethyl)-2-hydrazinylquinazolin-4-amine is NNc1nc(NCCC2CCC2)c2ccccc2n1.
What is the InChIKey of N-(2-cyclobutylethyl)-2-hydrazinylquinazolin-4-amine?
The InChIKey is HYGLSVDZPCZYEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5/c15-19-14-17-12-7-2-1-6-11(12)13(18-14)16-9-8-10-4-3-5-10/h1-2,6-7,10H,3-5,8-9,15H2,(H2,16,17,18,19).
What are the key properties of N-(2-cyclobutylethyl)-2-hydrazinylquinazolin-4-amine?
N-(2-cyclobutylethyl)-2-hydrazinylquinazolin-4-amine has a molecular weight of 257.34 g/mol, XLogP of 2.52, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclobutylethyl)-2-hydrazinylquinazolin-4-amine is sourced from PubChem (CID 113479557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).