2-(3-cyclohexyl-2-oxoimidazo[4,5-b]pyridin-1-yl)-N-(2-morpholin-4-ylethyl)acetamide

C20H29N5O3 — CID 53159343

IUPAC2-(3-cyclohexyl-2-oxoimidazo[4,5-b]pyridin-1-yl)-N-(2-morpholin-4-ylethyl)acetamide
SMILESO=C(Cn1c(=O)n(C2CCCCC2)c2ncccc21)NCCN1CCOCC1
InChIInChI=1S/C20H29N5O3/c26-18(21-9-10-23-11-13-28-14-12-23)15-24-17-7-4-8-22-19(17)25(20(24)27)16-5-2-1-3-6-16/h4,7-8,16H,1-3,5-6,9-15H2,(H,21,26)
InChIKeyIPFGJBVOYSXOGV-UHFFFAOYSA-N
MW387.48 g/mol
LogP1.15
Rot. Bonds6

About 2-(3-cyclohexyl-2-oxoimidazo[4,5-b]pyridin-1-yl)-N-(2-morpholin-4-ylethyl)acetamide

2-(3-cyclohexyl-2-oxoimidazo[4,5-b]pyridin-1-yl)-N-(2-morpholin-4-ylethyl)acetamide (PubChem CID 53159343) has the molecular formula C20H29N5O3 and a molecular weight of 387.48 g/mol. Its IUPAC name is 2-(3-cyclohexyl-2-oxoimidazo[4,5-b]pyridin-1-yl)-N-(2-morpholin-4-ylethyl)acetamide.

Molecular Properties

Compound Name2-(3-cyclohexyl-2-oxoimidazo[4,5-b]pyridin-1-yl)-N-(2-morpholin-4-ylethyl)acetamide
PubChem CID53159343
Molecular FormulaC20H29N5O3
Molecular Weight387.48 g/mol
Exact Mass387.23
IUPAC Name2-(3-cyclohexyl-2-oxoimidazo[4,5-b]pyridin-1-yl)-N-(2-morpholin-4-ylethyl)acetamide
SMILESO=C(Cn1c(=O)n(C2CCCCC2)c2ncccc21)NCCN1CCOCC1
InChIInChI=1S/C20H29N5O3/c26-18(21-9-10-23-11-13-28-14-12-23)15-24-17-7-4-8-22-19(17)25(20(24)27)16-5-2-1-3-6-16/h4,7-8,16H,1-3,5-6,9-15H2,(H,21,26)
InChIKeyIPFGJBVOYSXOGV-UHFFFAOYSA-N
XLogP1.15
TPSA81.39 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.48
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-(3-cyclohexyl-2-oxoimidazo[4,5-b]pyridin-1-yl)-N-(2-morpholin-4-ylethyl)acetamide?
The IUPAC name of 2-(3-cyclohexyl-2-oxoimidazo[4,5-b]pyridin-1-yl)-N-(2-morpholin-4-ylethyl)acetamide (CID 53159343) is 2-(3-cyclohexyl-2-oxoimidazo[4,5-b]pyridin-1-yl)-N-(2-morpholin-4-ylethyl)acetamide.
What is the SMILES notation for 2-(3-cyclohexyl-2-oxoimidazo[4,5-b]pyridin-1-yl)-N-(2-morpholin-4-ylethyl)acetamide?
The canonical SMILES for 2-(3-cyclohexyl-2-oxoimidazo[4,5-b]pyridin-1-yl)-N-(2-morpholin-4-ylethyl)acetamide is O=C(Cn1c(=O)n(C2CCCCC2)c2ncccc21)NCCN1CCOCC1.
What is the InChIKey of 2-(3-cyclohexyl-2-oxoimidazo[4,5-b]pyridin-1-yl)-N-(2-morpholin-4-ylethyl)acetamide?
The InChIKey is IPFGJBVOYSXOGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H29N5O3/c26-18(21-9-10-23-11-13-28-14-12-23)15-24-17-7-4-8-22-19(17)25(20(24)27)16-5-2-1-3-6-16/h4,7-8,16H,1-3,5-6,9-15H2,(H,21,26).
What are the key properties of 2-(3-cyclohexyl-2-oxoimidazo[4,5-b]pyridin-1-yl)-N-(2-morpholin-4-ylethyl)acetamide?
2-(3-cyclohexyl-2-oxoimidazo[4,5-b]pyridin-1-yl)-N-(2-morpholin-4-ylethyl)acetamide has a molecular weight of 387.48 g/mol, XLogP of 1.15, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-cyclohexyl-2-oxoimidazo[4,5-b]pyridin-1-yl)-N-(2-morpholin-4-ylethyl)acetamide is sourced from PubChem (CID 53159343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).