6-(2-phenylimidazo[1,2-a]pyridin-6-yl)-N-(1H-pyrazol-5-yl)quinazolin-4-amine

C24H17N7 — CID 168873005

IUPAC6-(2-phenylimidazo[1,2-a]pyridin-6-yl)-N-(1H-pyrazol-5-yl)quinazolin-4-amine
SMILESc1ccc(-c2cn3cc(-c4ccc5ncnc(Nc6ccn[nH]6)c5c4)ccc3n2)cc1
InChIInChI=1S/C24H17N7/c1-2-4-16(5-3-1)21-14-31-13-18(7-9-23(31)28-21)17-6-8-20-19(12-17)24(26-15-25-20)29-22-10-11-27-30-22/h1-15H,(H2,25,26,27,29,30)
InChIKeyYFTNGYCNOJGCPQ-UHFFFAOYSA-N
MW403.45 g/mol
LogP5.08
Rot. Bonds4

About 6-(2-phenylimidazo[1,2-a]pyridin-6-yl)-N-(1H-pyrazol-5-yl)quinazolin-4-amine

6-(2-phenylimidazo[1,2-a]pyridin-6-yl)-N-(1H-pyrazol-5-yl)quinazolin-4-amine (PubChem CID 168873005) has the molecular formula C24H17N7 and a molecular weight of 403.45 g/mol. Its IUPAC name is 6-(2-phenylimidazo[1,2-a]pyridin-6-yl)-N-(1H-pyrazol-5-yl)quinazolin-4-amine.

Molecular Properties

Compound Name6-(2-phenylimidazo[1,2-a]pyridin-6-yl)-N-(1H-pyrazol-5-yl)quinazolin-4-amine
PubChem CID168873005
Molecular FormulaC24H17N7
Molecular Weight403.45 g/mol
Exact Mass403.15
IUPAC Name6-(2-phenylimidazo[1,2-a]pyridin-6-yl)-N-(1H-pyrazol-5-yl)quinazolin-4-amine
SMILESc1ccc(-c2cn3cc(-c4ccc5ncnc(Nc6ccn[nH]6)c5c4)ccc3n2)cc1
InChIInChI=1S/C24H17N7/c1-2-4-16(5-3-1)21-14-31-13-18(7-9-23(31)28-21)17-6-8-20-19(12-17)24(26-15-25-20)29-22-10-11-27-30-22/h1-15H,(H2,25,26,27,29,30)
InChIKeyYFTNGYCNOJGCPQ-UHFFFAOYSA-N
XLogP5.08
TPSA83.79 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms31
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500403.45
LogP ≤ 55.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-(2-phenylimidazo[1,2-a]pyridin-6-yl)-N-(1H-pyrazol-5-yl)quinazolin-4-amine?
The IUPAC name of 6-(2-phenylimidazo[1,2-a]pyridin-6-yl)-N-(1H-pyrazol-5-yl)quinazolin-4-amine (CID 168873005) is 6-(2-phenylimidazo[1,2-a]pyridin-6-yl)-N-(1H-pyrazol-5-yl)quinazolin-4-amine.
What is the SMILES notation for 6-(2-phenylimidazo[1,2-a]pyridin-6-yl)-N-(1H-pyrazol-5-yl)quinazolin-4-amine?
The canonical SMILES for 6-(2-phenylimidazo[1,2-a]pyridin-6-yl)-N-(1H-pyrazol-5-yl)quinazolin-4-amine is c1ccc(-c2cn3cc(-c4ccc5ncnc(Nc6ccn[nH]6)c5c4)ccc3n2)cc1.
What is the InChIKey of 6-(2-phenylimidazo[1,2-a]pyridin-6-yl)-N-(1H-pyrazol-5-yl)quinazolin-4-amine?
The InChIKey is YFTNGYCNOJGCPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H17N7/c1-2-4-16(5-3-1)21-14-31-13-18(7-9-23(31)28-21)17-6-8-20-19(12-17)24(26-15-25-20)29-22-10-11-27-30-22/h1-15H,(H2,25,26,27,29,30).
What are the key properties of 6-(2-phenylimidazo[1,2-a]pyridin-6-yl)-N-(1H-pyrazol-5-yl)quinazolin-4-amine?
6-(2-phenylimidazo[1,2-a]pyridin-6-yl)-N-(1H-pyrazol-5-yl)quinazolin-4-amine has a molecular weight of 403.45 g/mol, XLogP of 5.08, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-phenylimidazo[1,2-a]pyridin-6-yl)-N-(1H-pyrazol-5-yl)quinazolin-4-amine is sourced from PubChem (CID 168873005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).