3-methyl-N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)imidazo[4,5-b]pyridine-6-carboxamide

C19H22N6O2 — CID 176504455

IUPAC3-methyl-N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)imidazo[4,5-b]pyridine-6-carboxamide
SMILESCn1cnc2cc(C(=O)NCC(c3ccccn3)N3CCOCC3)cnc21
InChIInChI=1S/C19H22N6O2/c1-24-13-23-16-10-14(11-21-18(16)24)19(26)22-12-17(15-4-2-3-5-20-15)25-6-8-27-9-7-25/h2-5,10-11,13,17H,6-9,12H2,1H3,(H,22,26)
InChIKeyDKBPIUDCZBMRRX-UHFFFAOYSA-N
MW366.43 g/mol
LogP1.17
Rot. Bonds5

About 3-methyl-N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)imidazo[4,5-b]pyridine-6-carboxamide

3-methyl-N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)imidazo[4,5-b]pyridine-6-carboxamide (PubChem CID 176504455) has the molecular formula C19H22N6O2 and a molecular weight of 366.43 g/mol. Its IUPAC name is 3-methyl-N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)imidazo[4,5-b]pyridine-6-carboxamide.

Molecular Properties

Compound Name3-methyl-N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)imidazo[4,5-b]pyridine-6-carboxamide
PubChem CID176504455
Molecular FormulaC19H22N6O2
Molecular Weight366.43 g/mol
Exact Mass366.18
IUPAC Name3-methyl-N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)imidazo[4,5-b]pyridine-6-carboxamide
SMILESCn1cnc2cc(C(=O)NCC(c3ccccn3)N3CCOCC3)cnc21
InChIInChI=1S/C19H22N6O2/c1-24-13-23-16-10-14(11-21-18(16)24)19(26)22-12-17(15-4-2-3-5-20-15)25-6-8-27-9-7-25/h2-5,10-11,13,17H,6-9,12H2,1H3,(H,22,26)
InChIKeyDKBPIUDCZBMRRX-UHFFFAOYSA-N
XLogP1.17
TPSA85.17 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.43
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)imidazo[4,5-b]pyridine-6-carboxamide?
The IUPAC name of 3-methyl-N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)imidazo[4,5-b]pyridine-6-carboxamide (CID 176504455) is 3-methyl-N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)imidazo[4,5-b]pyridine-6-carboxamide.
What is the SMILES notation for 3-methyl-N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)imidazo[4,5-b]pyridine-6-carboxamide?
The canonical SMILES for 3-methyl-N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)imidazo[4,5-b]pyridine-6-carboxamide is Cn1cnc2cc(C(=O)NCC(c3ccccn3)N3CCOCC3)cnc21.
What is the InChIKey of 3-methyl-N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)imidazo[4,5-b]pyridine-6-carboxamide?
The InChIKey is DKBPIUDCZBMRRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N6O2/c1-24-13-23-16-10-14(11-21-18(16)24)19(26)22-12-17(15-4-2-3-5-20-15)25-6-8-27-9-7-25/h2-5,10-11,13,17H,6-9,12H2,1H3,(H,22,26).
What are the key properties of 3-methyl-N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)imidazo[4,5-b]pyridine-6-carboxamide?
3-methyl-N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)imidazo[4,5-b]pyridine-6-carboxamide has a molecular weight of 366.43 g/mol, XLogP of 1.17, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)imidazo[4,5-b]pyridine-6-carboxamide is sourced from PubChem (CID 176504455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).