4-[5-[3-(6-methyl-3-pyridinyl)imidazo[4,5-c]pyridin-2-yl]pyrimidin-2-yl]morpholine

C20H19N7O — CID 86270193

IUPAC4-[5-[3-(6-methyl-3-pyridinyl)imidazo[4,5-c]pyridin-2-yl]pyrimidin-2-yl]morpholine
SMILESCc1ccc(-n2c(-c3cnc(N4CCOCC4)nc3)nc3ccncc32)cn1
InChIInChI=1S/C20H19N7O/c1-14-2-3-16(12-22-14)27-18-13-21-5-4-17(18)25-19(27)15-10-23-20(24-11-15)26-6-8-28-9-7-26/h2-5,10-13H,6-9H2,1H3
InChIKeyZEKSIPKPXLCWJY-UHFFFAOYSA-N
MW373.42 g/mol
LogP2.42
Rot. Bonds3

About 4-[5-[3-(6-methyl-3-pyridinyl)imidazo[4,5-c]pyridin-2-yl]pyrimidin-2-yl]morpholine

4-[5-[3-(6-methyl-3-pyridinyl)imidazo[4,5-c]pyridin-2-yl]pyrimidin-2-yl]morpholine (PubChem CID 86270193) has the molecular formula C20H19N7O and a molecular weight of 373.42 g/mol. Its IUPAC name is 4-[5-[3-(6-methyl-3-pyridinyl)imidazo[4,5-c]pyridin-2-yl]pyrimidin-2-yl]morpholine.

Molecular Properties

Compound Name4-[5-[3-(6-methyl-3-pyridinyl)imidazo[4,5-c]pyridin-2-yl]pyrimidin-2-yl]morpholine
PubChem CID86270193
Molecular FormulaC20H19N7O
Molecular Weight373.42 g/mol
Exact Mass373.17
IUPAC Name4-[5-[3-(6-methyl-3-pyridinyl)imidazo[4,5-c]pyridin-2-yl]pyrimidin-2-yl]morpholine
SMILESCc1ccc(-n2c(-c3cnc(N4CCOCC4)nc3)nc3ccncc32)cn1
InChIInChI=1S/C20H19N7O/c1-14-2-3-16(12-22-14)27-18-13-21-5-4-17(18)25-19(27)15-10-23-20(24-11-15)26-6-8-28-9-7-26/h2-5,10-13H,6-9H2,1H3
InChIKeyZEKSIPKPXLCWJY-UHFFFAOYSA-N
XLogP2.42
TPSA81.85 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.42
LogP ≤ 52.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 4-[5-[3-(6-methyl-3-pyridinyl)imidazo[4,5-c]pyridin-2-yl]pyrimidin-2-yl]morpholine?
The IUPAC name of 4-[5-[3-(6-methyl-3-pyridinyl)imidazo[4,5-c]pyridin-2-yl]pyrimidin-2-yl]morpholine (CID 86270193) is 4-[5-[3-(6-methyl-3-pyridinyl)imidazo[4,5-c]pyridin-2-yl]pyrimidin-2-yl]morpholine.
What is the SMILES notation for 4-[5-[3-(6-methyl-3-pyridinyl)imidazo[4,5-c]pyridin-2-yl]pyrimidin-2-yl]morpholine?
The canonical SMILES for 4-[5-[3-(6-methyl-3-pyridinyl)imidazo[4,5-c]pyridin-2-yl]pyrimidin-2-yl]morpholine is Cc1ccc(-n2c(-c3cnc(N4CCOCC4)nc3)nc3ccncc32)cn1.
What is the InChIKey of 4-[5-[3-(6-methyl-3-pyridinyl)imidazo[4,5-c]pyridin-2-yl]pyrimidin-2-yl]morpholine?
The InChIKey is ZEKSIPKPXLCWJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N7O/c1-14-2-3-16(12-22-14)27-18-13-21-5-4-17(18)25-19(27)15-10-23-20(24-11-15)26-6-8-28-9-7-26/h2-5,10-13H,6-9H2,1H3.
What are the key properties of 4-[5-[3-(6-methyl-3-pyridinyl)imidazo[4,5-c]pyridin-2-yl]pyrimidin-2-yl]morpholine?
4-[5-[3-(6-methyl-3-pyridinyl)imidazo[4,5-c]pyridin-2-yl]pyrimidin-2-yl]morpholine has a molecular weight of 373.42 g/mol, XLogP of 2.42, 3 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-[3-(6-methyl-3-pyridinyl)imidazo[4,5-c]pyridin-2-yl]pyrimidin-2-yl]morpholine is sourced from PubChem (CID 86270193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).