6-cyclopropyl-N-(2-phenylimidazo[1,2-a]pyrimidin-7-yl)-3-(pyrimidin-5-ylamino)pyridine-2-carboxamide

C25H20N8O — CID 53468024

IUPAC6-cyclopropyl-N-(2-phenylimidazo[1,2-a]pyrimidin-7-yl)-3-(pyrimidin-5-ylamino)pyridine-2-carboxamide
SMILESO=C(Nc1ccn2cc(-c3ccccc3)nc2n1)c1nc(C2CC2)ccc1Nc1cncnc1
InChIInChI=1S/C25H20N8O/c34-24(23-20(28-18-12-26-15-27-13-18)9-8-19(29-23)17-6-7-17)31-22-10-11-33-14-21(30-25(33)32-22)16-4-2-1-3-5-16/h1-5,8-15,17,28H,6-7H2,(H,30,31,32,34)
InChIKeySYPRSJMEVONNBB-UHFFFAOYSA-N
MW448.49 g/mol
LogP4.45
Rot. Bonds6

About 6-cyclopropyl-N-(2-phenylimidazo[1,2-a]pyrimidin-7-yl)-3-(pyrimidin-5-ylamino)pyridine-2-carboxamide

6-cyclopropyl-N-(2-phenylimidazo[1,2-a]pyrimidin-7-yl)-3-(pyrimidin-5-ylamino)pyridine-2-carboxamide (PubChem CID 53468024) has the molecular formula C25H20N8O and a molecular weight of 448.49 g/mol. Its IUPAC name is 6-cyclopropyl-N-(2-phenylimidazo[1,2-a]pyrimidin-7-yl)-3-(pyrimidin-5-ylamino)pyridine-2-carboxamide.

Molecular Properties

Compound Name6-cyclopropyl-N-(2-phenylimidazo[1,2-a]pyrimidin-7-yl)-3-(pyrimidin-5-ylamino)pyridine-2-carboxamide
PubChem CID53468024
Molecular FormulaC25H20N8O
Molecular Weight448.49 g/mol
Exact Mass448.18
IUPAC Name6-cyclopropyl-N-(2-phenylimidazo[1,2-a]pyrimidin-7-yl)-3-(pyrimidin-5-ylamino)pyridine-2-carboxamide
SMILESO=C(Nc1ccn2cc(-c3ccccc3)nc2n1)c1nc(C2CC2)ccc1Nc1cncnc1
InChIInChI=1S/C25H20N8O/c34-24(23-20(28-18-12-26-15-27-13-18)9-8-19(29-23)17-6-7-17)31-22-10-11-33-14-21(30-25(33)32-22)16-4-2-1-3-5-16/h1-5,8-15,17,28H,6-7H2,(H,30,31,32,34)
InChIKeySYPRSJMEVONNBB-UHFFFAOYSA-N
XLogP4.45
TPSA109.99 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500448.49
LogP ≤ 54.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze 6-cyclopropyl-N-(2-phenylimidazo[1,2-a]pyrimidin-7-yl)-3-(pyrimidin-5-ylamino)pyridine-2-carboxamide 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-cyclopropyl-N-(2-phenylimidazo[1,2-a]pyrimidin-7-yl)-3-(pyrimidin-5-ylamino)pyridine-2-carboxamide?
The IUPAC name of 6-cyclopropyl-N-(2-phenylimidazo[1,2-a]pyrimidin-7-yl)-3-(pyrimidin-5-ylamino)pyridine-2-carboxamide (CID 53468024) is 6-cyclopropyl-N-(2-phenylimidazo[1,2-a]pyrimidin-7-yl)-3-(pyrimidin-5-ylamino)pyridine-2-carboxamide.
What is the SMILES notation for 6-cyclopropyl-N-(2-phenylimidazo[1,2-a]pyrimidin-7-yl)-3-(pyrimidin-5-ylamino)pyridine-2-carboxamide?
The canonical SMILES for 6-cyclopropyl-N-(2-phenylimidazo[1,2-a]pyrimidin-7-yl)-3-(pyrimidin-5-ylamino)pyridine-2-carboxamide is O=C(Nc1ccn2cc(-c3ccccc3)nc2n1)c1nc(C2CC2)ccc1Nc1cncnc1.
What is the InChIKey of 6-cyclopropyl-N-(2-phenylimidazo[1,2-a]pyrimidin-7-yl)-3-(pyrimidin-5-ylamino)pyridine-2-carboxamide?
The InChIKey is SYPRSJMEVONNBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H20N8O/c34-24(23-20(28-18-12-26-15-27-13-18)9-8-19(29-23)17-6-7-17)31-22-10-11-33-14-21(30-25(33)32-22)16-4-2-1-3-5-16/h1-5,8-15,17,28H,6-7H2,(H,30,31,32,34).
What are the key properties of 6-cyclopropyl-N-(2-phenylimidazo[1,2-a]pyrimidin-7-yl)-3-(pyrimidin-5-ylamino)pyridine-2-carboxamide?
6-cyclopropyl-N-(2-phenylimidazo[1,2-a]pyrimidin-7-yl)-3-(pyrimidin-5-ylamino)pyridine-2-carboxamide has a molecular weight of 448.49 g/mol, XLogP of 4.45, 6 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-N-(2-phenylimidazo[1,2-a]pyrimidin-7-yl)-3-(pyrimidin-5-ylamino)pyridine-2-carboxamide is sourced from PubChem (CID 53468024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).