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

C22H22N6O — CID 90421392

IUPAC4-[4-methyl-5-[3-(6-methyl-3-pyridinyl)imidazo[4,5-c]pyridin-2-yl]-2-pyridinyl]morpholine
SMILESCc1ccc(-n2c(-c3cnc(N4CCOCC4)cc3C)nc3ccncc32)cn1
InChIInChI=1S/C22H22N6O/c1-15-11-21(27-7-9-29-10-8-27)25-13-18(15)22-26-19-5-6-23-14-20(19)28(22)17-4-3-16(2)24-12-17/h3-6,11-14H,7-10H2,1-2H3
InChIKeyLQRYOQKJPJNDDF-UHFFFAOYSA-N
MW386.46 g/mol
LogP3.33
Rot. Bonds3

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

4-[4-methyl-5-[3-(6-methyl-3-pyridinyl)imidazo[4,5-c]pyridin-2-yl]-2-pyridinyl]morpholine (PubChem CID 90421392) has the molecular formula C22H22N6O and a molecular weight of 386.46 g/mol. Its IUPAC name is 4-[4-methyl-5-[3-(6-methyl-3-pyridinyl)imidazo[4,5-c]pyridin-2-yl]-2-pyridinyl]morpholine.

Molecular Properties

Compound Name4-[4-methyl-5-[3-(6-methyl-3-pyridinyl)imidazo[4,5-c]pyridin-2-yl]-2-pyridinyl]morpholine
PubChem CID90421392
Molecular FormulaC22H22N6O
Molecular Weight386.46 g/mol
Exact Mass386.19
IUPAC Name4-[4-methyl-5-[3-(6-methyl-3-pyridinyl)imidazo[4,5-c]pyridin-2-yl]-2-pyridinyl]morpholine
SMILESCc1ccc(-n2c(-c3cnc(N4CCOCC4)cc3C)nc3ccncc32)cn1
InChIInChI=1S/C22H22N6O/c1-15-11-21(27-7-9-29-10-8-27)25-13-18(15)22-26-19-5-6-23-14-20(19)28(22)17-4-3-16(2)24-12-17/h3-6,11-14H,7-10H2,1-2H3
InChIKeyLQRYOQKJPJNDDF-UHFFFAOYSA-N
XLogP3.33
TPSA68.96 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.46
LogP ≤ 53.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4-[4-methyl-5-[3-(6-methyl-3-pyridinyl)imidazo[4,5-c]pyridin-2-yl]-2-pyridinyl]morpholine?
The IUPAC name of 4-[4-methyl-5-[3-(6-methyl-3-pyridinyl)imidazo[4,5-c]pyridin-2-yl]-2-pyridinyl]morpholine (CID 90421392) is 4-[4-methyl-5-[3-(6-methyl-3-pyridinyl)imidazo[4,5-c]pyridin-2-yl]-2-pyridinyl]morpholine.
What is the SMILES notation for 4-[4-methyl-5-[3-(6-methyl-3-pyridinyl)imidazo[4,5-c]pyridin-2-yl]-2-pyridinyl]morpholine?
The canonical SMILES for 4-[4-methyl-5-[3-(6-methyl-3-pyridinyl)imidazo[4,5-c]pyridin-2-yl]-2-pyridinyl]morpholine is Cc1ccc(-n2c(-c3cnc(N4CCOCC4)cc3C)nc3ccncc32)cn1.
What is the InChIKey of 4-[4-methyl-5-[3-(6-methyl-3-pyridinyl)imidazo[4,5-c]pyridin-2-yl]-2-pyridinyl]morpholine?
The InChIKey is LQRYOQKJPJNDDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N6O/c1-15-11-21(27-7-9-29-10-8-27)25-13-18(15)22-26-19-5-6-23-14-20(19)28(22)17-4-3-16(2)24-12-17/h3-6,11-14H,7-10H2,1-2H3.
What are the key properties of 4-[4-methyl-5-[3-(6-methyl-3-pyridinyl)imidazo[4,5-c]pyridin-2-yl]-2-pyridinyl]morpholine?
4-[4-methyl-5-[3-(6-methyl-3-pyridinyl)imidazo[4,5-c]pyridin-2-yl]-2-pyridinyl]morpholine has a molecular weight of 386.46 g/mol, XLogP of 3.33, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-methyl-5-[3-(6-methyl-3-pyridinyl)imidazo[4,5-c]pyridin-2-yl]-2-pyridinyl]morpholine is sourced from PubChem (CID 90421392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).