N-(furan-2-ylmethyl)-2-phenylquinazolin-4-amine

C19H15N3O — CID 719250

IUPACN-(furan-2-ylmethyl)-2-phenylquinazolin-4-amine
SMILESc1ccc(-c2nc(NCc3ccco3)c3ccccc3n2)cc1
InChIInChI=1S/C19H15N3O/c1-2-7-14(8-3-1)18-21-17-11-5-4-10-16(17)19(22-18)20-13-15-9-6-12-23-15/h1-12H,13H2,(H,20,21,22)
InChIKeyAZNLVBWSZDPKAA-UHFFFAOYSA-N
MW301.35 g/mol
LogP4.50
Rot. Bonds4

About N-(furan-2-ylmethyl)-2-phenylquinazolin-4-amine

N-(furan-2-ylmethyl)-2-phenylquinazolin-4-amine (PubChem CID 719250) has the molecular formula C19H15N3O and a molecular weight of 301.35 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-2-phenylquinazolin-4-amine.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-2-phenylquinazolin-4-amine
PubChem CID719250
Molecular FormulaC19H15N3O
Molecular Weight301.35 g/mol
Exact Mass301.12
IUPAC NameN-(furan-2-ylmethyl)-2-phenylquinazolin-4-amine
SMILESc1ccc(-c2nc(NCc3ccco3)c3ccccc3n2)cc1
InChIInChI=1S/C19H15N3O/c1-2-7-14(8-3-1)18-21-17-11-5-4-10-16(17)19(22-18)20-13-15-9-6-12-23-15/h1-12H,13H2,(H,20,21,22)
InChIKeyAZNLVBWSZDPKAA-UHFFFAOYSA-N
XLogP4.50
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.35
LogP ≤ 54.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-2-phenylquinazolin-4-amine?
The IUPAC name of N-(furan-2-ylmethyl)-2-phenylquinazolin-4-amine (CID 719250) is N-(furan-2-ylmethyl)-2-phenylquinazolin-4-amine.
What is the SMILES notation for N-(furan-2-ylmethyl)-2-phenylquinazolin-4-amine?
The canonical SMILES for N-(furan-2-ylmethyl)-2-phenylquinazolin-4-amine is c1ccc(-c2nc(NCc3ccco3)c3ccccc3n2)cc1.
What is the InChIKey of N-(furan-2-ylmethyl)-2-phenylquinazolin-4-amine?
The InChIKey is AZNLVBWSZDPKAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N3O/c1-2-7-14(8-3-1)18-21-17-11-5-4-10-16(17)19(22-18)20-13-15-9-6-12-23-15/h1-12H,13H2,(H,20,21,22).
What are the key properties of N-(furan-2-ylmethyl)-2-phenylquinazolin-4-amine?
N-(furan-2-ylmethyl)-2-phenylquinazolin-4-amine has a molecular weight of 301.35 g/mol, XLogP of 4.50, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-2-phenylquinazolin-4-amine is sourced from PubChem (CID 719250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).