2-pyridin-3-yl-6-pyrimidin-5-ylquinazolin-4-amine

C17H12N6 — CID 71180731

IUPAC2-pyridin-3-yl-6-pyrimidin-5-ylquinazolin-4-amine
SMILESNc1nc(-c2cccnc2)nc2ccc(-c3cncnc3)cc12
InChIInChI=1S/C17H12N6/c18-16-14-6-11(13-8-20-10-21-9-13)3-4-15(14)22-17(23-16)12-2-1-5-19-7-12/h1-10H,(H2,18,22,23)
InChIKeyBUWUJOUVEGOMEH-UHFFFAOYSA-N
MW300.33 g/mol
LogP2.73
Rot. Bonds2

About 2-pyridin-3-yl-6-pyrimidin-5-ylquinazolin-4-amine

2-pyridin-3-yl-6-pyrimidin-5-ylquinazolin-4-amine (PubChem CID 71180731) has the molecular formula C17H12N6 and a molecular weight of 300.33 g/mol. Its IUPAC name is 2-pyridin-3-yl-6-pyrimidin-5-ylquinazolin-4-amine.

Molecular Properties

Compound Name2-pyridin-3-yl-6-pyrimidin-5-ylquinazolin-4-amine
PubChem CID71180731
Molecular FormulaC17H12N6
Molecular Weight300.33 g/mol
Exact Mass300.11
IUPAC Name2-pyridin-3-yl-6-pyrimidin-5-ylquinazolin-4-amine
SMILESNc1nc(-c2cccnc2)nc2ccc(-c3cncnc3)cc12
InChIInChI=1S/C17H12N6/c18-16-14-6-11(13-8-20-10-21-9-13)3-4-15(14)22-17(23-16)12-2-1-5-19-7-12/h1-10H,(H2,18,22,23)
InChIKeyBUWUJOUVEGOMEH-UHFFFAOYSA-N
XLogP2.73
TPSA90.47 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.33
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-amino-2-pyridin-3-ylquinazolin-6-ol
CID 141310515
6-(3-methylperoxyphenyl)-2-pyridin-3-ylquinazolin-4-amine
CID 135128031
7-methyl-2-pyridin-3-ylquinazolin-4-amine
CID 90989362
methanamine;2-[(2-pyridin-3-yl-6-pyrimidin-5-ylquinazolin-4-yl)amino]benzaldehyde
CID 144501483
2-[(2-pyridin-3-yl-6-pyrimidin-5-ylquinazolin-4-yl)amino]benzaldehyde
CID 144501484
6-(4-aminophenyl)-N-propan-2-yl-2-pyridin-3-ylquinazolin-4-amine
CID 89347971
N-methyl-6-(4-methylphenyl)-2-pyridin-3-ylquinazolin-4-amine
CID 71180199
2-[3-[3-[4-(3-phenylphenyl)phenyl]phenyl]phenyl]-4,6-dipyridin-3-yl-1,3,5-triazine
CID 153435459
3-[4-(methylamino)-2-pyridin-3-ylquinazolin-6-yl]phenol
CID 67297993
acetyl acetate;6-bromo-2-pyridin-3-ylquinazolin-4-amine;N-(6-bromo-2-pyridin-3-ylquinazolin-4-yl)acetamide;methane
CID 162215624
4-methoxy-6-(6-methoxy-3-pyridinyl)-2-pyridin-3-ylquinazoline
CID 71181256
4-chloro-6-(5-methoxy-3-pyridinyl)-2-pyridin-3-ylquinazoline
CID 89417196

Frequently Asked Questions

What is the IUPAC name of 2-pyridin-3-yl-6-pyrimidin-5-ylquinazolin-4-amine?
The IUPAC name of 2-pyridin-3-yl-6-pyrimidin-5-ylquinazolin-4-amine (CID 71180731) is 2-pyridin-3-yl-6-pyrimidin-5-ylquinazolin-4-amine.
What is the SMILES notation for 2-pyridin-3-yl-6-pyrimidin-5-ylquinazolin-4-amine?
The canonical SMILES for 2-pyridin-3-yl-6-pyrimidin-5-ylquinazolin-4-amine is Nc1nc(-c2cccnc2)nc2ccc(-c3cncnc3)cc12.
What is the InChIKey of 2-pyridin-3-yl-6-pyrimidin-5-ylquinazolin-4-amine?
The InChIKey is BUWUJOUVEGOMEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12N6/c18-16-14-6-11(13-8-20-10-21-9-13)3-4-15(14)22-17(23-16)12-2-1-5-19-7-12/h1-10H,(H2,18,22,23).
What are the key properties of 2-pyridin-3-yl-6-pyrimidin-5-ylquinazolin-4-amine?
2-pyridin-3-yl-6-pyrimidin-5-ylquinazolin-4-amine has a molecular weight of 300.33 g/mol, XLogP of 2.73, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyridin-3-yl-6-pyrimidin-5-ylquinazolin-4-amine is sourced from PubChem (CID 71180731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).