N-cyclopropyl-2-(furan-3-yl)quinazolin-4-amine

C15H13N3O — CID 3235164

IUPACN-cyclopropyl-2-(furan-3-yl)quinazolin-4-amine
SMILESc1ccc2c(NC3CC3)nc(-c3ccoc3)nc2c1
InChIInChI=1S/C15H13N3O/c1-2-4-13-12(3-1)15(16-11-5-6-11)18-14(17-13)10-7-8-19-9-10/h1-4,7-9,11H,5-6H2,(H,16,17,18)
InChIKeyNLSDFRVYVAISOU-UHFFFAOYSA-N
MW251.29 g/mol
LogP3.46
Rot. Bonds3

About N-cyclopropyl-2-(furan-3-yl)quinazolin-4-amine

N-cyclopropyl-2-(furan-3-yl)quinazolin-4-amine (PubChem CID 3235164) has the molecular formula C15H13N3O and a molecular weight of 251.29 g/mol. Its IUPAC name is N-cyclopropyl-2-(furan-3-yl)quinazolin-4-amine.

Molecular Properties

Compound NameN-cyclopropyl-2-(furan-3-yl)quinazolin-4-amine
PubChem CID3235164
Molecular FormulaC15H13N3O
Molecular Weight251.29 g/mol
Exact Mass251.11
IUPAC NameN-cyclopropyl-2-(furan-3-yl)quinazolin-4-amine
SMILESc1ccc2c(NC3CC3)nc(-c3ccoc3)nc2c1
InChIInChI=1S/C15H13N3O/c1-2-4-13-12(3-1)15(16-11-5-6-11)18-14(17-13)10-7-8-19-9-10/h1-4,7-9,11H,5-6H2,(H,16,17,18)
InChIKeyNLSDFRVYVAISOU-UHFFFAOYSA-N
XLogP3.46
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.29
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-(furan-3-yl)quinazolin-4-amine?
The IUPAC name of N-cyclopropyl-2-(furan-3-yl)quinazolin-4-amine (CID 3235164) is N-cyclopropyl-2-(furan-3-yl)quinazolin-4-amine.
What is the SMILES notation for N-cyclopropyl-2-(furan-3-yl)quinazolin-4-amine?
The canonical SMILES for N-cyclopropyl-2-(furan-3-yl)quinazolin-4-amine is c1ccc2c(NC3CC3)nc(-c3ccoc3)nc2c1.
What is the InChIKey of N-cyclopropyl-2-(furan-3-yl)quinazolin-4-amine?
The InChIKey is NLSDFRVYVAISOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O/c1-2-4-13-12(3-1)15(16-11-5-6-11)18-14(17-13)10-7-8-19-9-10/h1-4,7-9,11H,5-6H2,(H,16,17,18).
What are the key properties of N-cyclopropyl-2-(furan-3-yl)quinazolin-4-amine?
N-cyclopropyl-2-(furan-3-yl)quinazolin-4-amine has a molecular weight of 251.29 g/mol, XLogP of 3.46, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-(furan-3-yl)quinazolin-4-amine is sourced from PubChem (CID 3235164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).