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

C15H21N5 — CID 80898286

IUPACN-(2-cyclopentylethyl)-2-hydrazinylquinazolin-4-amine
SMILESNNc1nc(NCCC2CCCC2)c2ccccc2n1
InChIInChI=1S/C15H21N5/c16-20-15-18-13-8-4-3-7-12(13)14(19-15)17-10-9-11-5-1-2-6-11/h3-4,7-8,11H,1-2,5-6,9-10,16H2,(H2,17,18,19,20)
InChIKeyPNDRPGBTXQGVOZ-UHFFFAOYSA-N
MW271.37 g/mol
LogP2.91
Rot. Bonds5

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

N-(2-cyclopentylethyl)-2-hydrazinylquinazolin-4-amine (PubChem CID 80898286) has the molecular formula C15H21N5 and a molecular weight of 271.37 g/mol. Its IUPAC name is N-(2-cyclopentylethyl)-2-hydrazinylquinazolin-4-amine.

Molecular Properties

Compound NameN-(2-cyclopentylethyl)-2-hydrazinylquinazolin-4-amine
PubChem CID80898286
Molecular FormulaC15H21N5
Molecular Weight271.37 g/mol
Exact Mass271.18
IUPAC NameN-(2-cyclopentylethyl)-2-hydrazinylquinazolin-4-amine
SMILESNNc1nc(NCCC2CCCC2)c2ccccc2n1
InChIInChI=1S/C15H21N5/c16-20-15-18-13-8-4-3-7-12(13)14(19-15)17-10-9-11-5-1-2-6-11/h3-4,7-8,11H,1-2,5-6,9-10,16H2,(H2,17,18,19,20)
InChIKeyPNDRPGBTXQGVOZ-UHFFFAOYSA-N
XLogP2.91
TPSA75.86 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.37
LogP ≤ 52.91
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-cyclopentylethyl)-2-hydrazinylquinazolin-4-amine?
The IUPAC name of N-(2-cyclopentylethyl)-2-hydrazinylquinazolin-4-amine (CID 80898286) is N-(2-cyclopentylethyl)-2-hydrazinylquinazolin-4-amine.
What is the SMILES notation for N-(2-cyclopentylethyl)-2-hydrazinylquinazolin-4-amine?
The canonical SMILES for N-(2-cyclopentylethyl)-2-hydrazinylquinazolin-4-amine is NNc1nc(NCCC2CCCC2)c2ccccc2n1.
What is the InChIKey of N-(2-cyclopentylethyl)-2-hydrazinylquinazolin-4-amine?
The InChIKey is PNDRPGBTXQGVOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5/c16-20-15-18-13-8-4-3-7-12(13)14(19-15)17-10-9-11-5-1-2-6-11/h3-4,7-8,11H,1-2,5-6,9-10,16H2,(H2,17,18,19,20).
What are the key properties of N-(2-cyclopentylethyl)-2-hydrazinylquinazolin-4-amine?
N-(2-cyclopentylethyl)-2-hydrazinylquinazolin-4-amine has a molecular weight of 271.37 g/mol, XLogP of 2.91, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopentylethyl)-2-hydrazinylquinazolin-4-amine is sourced from PubChem (CID 80898286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).