N-(cyclopropylmethyl)-2-hydrazinyl-N-propan-2-ylquinazolin-4-amine

C15H21N5 — CID 80905482

IUPACN-(cyclopropylmethyl)-2-hydrazinyl-N-propan-2-ylquinazolin-4-amine
SMILESCC(C)N(CC1CC1)c1nc(NN)nc2ccccc12
InChIInChI=1S/C15H21N5/c1-10(2)20(9-11-7-8-11)14-12-5-3-4-6-13(12)17-15(18-14)19-16/h3-6,10-11H,7-9,16H2,1-2H3,(H,17,18,19)
InChIKeyZOADDRBVBQZSAB-UHFFFAOYSA-N
MW271.37 g/mol
LogP2.54
Rot. Bonds5

About N-(cyclopropylmethyl)-2-hydrazinyl-N-propan-2-ylquinazolin-4-amine

N-(cyclopropylmethyl)-2-hydrazinyl-N-propan-2-ylquinazolin-4-amine (PubChem CID 80905482) has the molecular formula C15H21N5 and a molecular weight of 271.37 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-2-hydrazinyl-N-propan-2-ylquinazolin-4-amine.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-2-hydrazinyl-N-propan-2-ylquinazolin-4-amine
PubChem CID80905482
Molecular FormulaC15H21N5
Molecular Weight271.37 g/mol
Exact Mass271.18
IUPAC NameN-(cyclopropylmethyl)-2-hydrazinyl-N-propan-2-ylquinazolin-4-amine
SMILESCC(C)N(CC1CC1)c1nc(NN)nc2ccccc12
InChIInChI=1S/C15H21N5/c1-10(2)20(9-11-7-8-11)14-12-5-3-4-6-13(12)17-15(18-14)19-16/h3-6,10-11H,7-9,16H2,1-2H3,(H,17,18,19)
InChIKeyZOADDRBVBQZSAB-UHFFFAOYSA-N
XLogP2.54
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.37
LogP ≤ 52.54
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 N-(cyclopropylmethyl)-2-hydrazinyl-N-propan-2-ylquinazolin-4-amine?
The IUPAC name of N-(cyclopropylmethyl)-2-hydrazinyl-N-propan-2-ylquinazolin-4-amine (CID 80905482) is N-(cyclopropylmethyl)-2-hydrazinyl-N-propan-2-ylquinazolin-4-amine.
What is the SMILES notation for N-(cyclopropylmethyl)-2-hydrazinyl-N-propan-2-ylquinazolin-4-amine?
The canonical SMILES for N-(cyclopropylmethyl)-2-hydrazinyl-N-propan-2-ylquinazolin-4-amine is CC(C)N(CC1CC1)c1nc(NN)nc2ccccc12.
What is the InChIKey of N-(cyclopropylmethyl)-2-hydrazinyl-N-propan-2-ylquinazolin-4-amine?
The InChIKey is ZOADDRBVBQZSAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5/c1-10(2)20(9-11-7-8-11)14-12-5-3-4-6-13(12)17-15(18-14)19-16/h3-6,10-11H,7-9,16H2,1-2H3,(H,17,18,19).
What are the key properties of N-(cyclopropylmethyl)-2-hydrazinyl-N-propan-2-ylquinazolin-4-amine?
N-(cyclopropylmethyl)-2-hydrazinyl-N-propan-2-ylquinazolin-4-amine has a molecular weight of 271.37 g/mol, XLogP of 2.54, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-2-hydrazinyl-N-propan-2-ylquinazolin-4-amine is sourced from PubChem (CID 80905482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).