6-(furan-3-yl)-N-[(5-methylpyrazin-2-yl)methyl]quinazolin-4-amine

C18H15N5O — CID 3233882

IUPAC6-(furan-3-yl)-N-[(5-methylpyrazin-2-yl)methyl]quinazolin-4-amine
SMILESCc1cnc(CNc2ncnc3ccc(-c4ccoc4)cc23)cn1
InChIInChI=1S/C18H15N5O/c1-12-7-20-15(8-19-12)9-21-18-16-6-13(14-4-5-24-10-14)2-3-17(16)22-11-23-18/h2-8,10-11H,9H2,1H3,(H,21,22,23)
InChIKeyBLHMZWORSSVRLT-UHFFFAOYSA-N
MW317.35 g/mol
LogP3.60
Rot. Bonds4

About 6-(furan-3-yl)-N-[(5-methylpyrazin-2-yl)methyl]quinazolin-4-amine

6-(furan-3-yl)-N-[(5-methylpyrazin-2-yl)methyl]quinazolin-4-amine (PubChem CID 3233882) has the molecular formula C18H15N5O and a molecular weight of 317.35 g/mol. Its IUPAC name is 6-(furan-3-yl)-N-[(5-methylpyrazin-2-yl)methyl]quinazolin-4-amine.

Molecular Properties

Compound Name6-(furan-3-yl)-N-[(5-methylpyrazin-2-yl)methyl]quinazolin-4-amine
PubChem CID3233882
Molecular FormulaC18H15N5O
Molecular Weight317.35 g/mol
Exact Mass317.13
IUPAC Name6-(furan-3-yl)-N-[(5-methylpyrazin-2-yl)methyl]quinazolin-4-amine
SMILESCc1cnc(CNc2ncnc3ccc(-c4ccoc4)cc23)cn1
InChIInChI=1S/C18H15N5O/c1-12-7-20-15(8-19-12)9-21-18-16-6-13(14-4-5-24-10-14)2-3-17(16)22-11-23-18/h2-8,10-11H,9H2,1H3,(H,21,22,23)
InChIKeyBLHMZWORSSVRLT-UHFFFAOYSA-N
XLogP3.60
TPSA76.73 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.35
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 6-(furan-3-yl)-N-[(5-methylpyrazin-2-yl)methyl]quinazolin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-(furan-3-yl)-N-[(5-methylpyrazin-2-yl)methyl]quinazolin-4-amine?
The IUPAC name of 6-(furan-3-yl)-N-[(5-methylpyrazin-2-yl)methyl]quinazolin-4-amine (CID 3233882) is 6-(furan-3-yl)-N-[(5-methylpyrazin-2-yl)methyl]quinazolin-4-amine.
What is the SMILES notation for 6-(furan-3-yl)-N-[(5-methylpyrazin-2-yl)methyl]quinazolin-4-amine?
The canonical SMILES for 6-(furan-3-yl)-N-[(5-methylpyrazin-2-yl)methyl]quinazolin-4-amine is Cc1cnc(CNc2ncnc3ccc(-c4ccoc4)cc23)cn1.
What is the InChIKey of 6-(furan-3-yl)-N-[(5-methylpyrazin-2-yl)methyl]quinazolin-4-amine?
The InChIKey is BLHMZWORSSVRLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N5O/c1-12-7-20-15(8-19-12)9-21-18-16-6-13(14-4-5-24-10-14)2-3-17(16)22-11-23-18/h2-8,10-11H,9H2,1H3,(H,21,22,23).
What are the key properties of 6-(furan-3-yl)-N-[(5-methylpyrazin-2-yl)methyl]quinazolin-4-amine?
6-(furan-3-yl)-N-[(5-methylpyrazin-2-yl)methyl]quinazolin-4-amine has a molecular weight of 317.35 g/mol, XLogP of 3.60, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(furan-3-yl)-N-[(5-methylpyrazin-2-yl)methyl]quinazolin-4-amine is sourced from PubChem (CID 3233882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).