6-methyl-N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]pyridine-2-carboxamide

C18H22N4O2 — CID 51080809

IUPAC6-methyl-N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]pyridine-2-carboxamide
SMILESCc1cccc(C(=O)NCc2ccc(N3CCOC(C)C3)nc2)n1
InChIInChI=1S/C18H22N4O2/c1-13-4-3-5-16(21-13)18(23)20-11-15-6-7-17(19-10-15)22-8-9-24-14(2)12-22/h3-7,10,14H,8-9,11-12H2,1-2H3,(H,20,23)
InChIKeyYKCRKMYFYAXLIX-UHFFFAOYSA-N
MW326.40 g/mol
LogP1.94
Rot. Bonds4

About 6-methyl-N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]pyridine-2-carboxamide

6-methyl-N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]pyridine-2-carboxamide (PubChem CID 51080809) has the molecular formula C18H22N4O2 and a molecular weight of 326.40 g/mol. Its IUPAC name is 6-methyl-N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-methyl-N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]pyridine-2-carboxamide
PubChem CID51080809
Molecular FormulaC18H22N4O2
Molecular Weight326.40 g/mol
Exact Mass326.17
IUPAC Name6-methyl-N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]pyridine-2-carboxamide
SMILESCc1cccc(C(=O)NCc2ccc(N3CCOC(C)C3)nc2)n1
InChIInChI=1S/C18H22N4O2/c1-13-4-3-5-16(21-13)18(23)20-11-15-6-7-17(19-10-15)22-8-9-24-14(2)12-22/h3-7,10,14H,8-9,11-12H2,1-2H3,(H,20,23)
InChIKeyYKCRKMYFYAXLIX-UHFFFAOYSA-N
XLogP1.94
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-methyl-N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]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-methyl-N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]pyridine-2-carboxamide?
The IUPAC name of 6-methyl-N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]pyridine-2-carboxamide (CID 51080809) is 6-methyl-N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]pyridine-2-carboxamide.
What is the SMILES notation for 6-methyl-N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]pyridine-2-carboxamide?
The canonical SMILES for 6-methyl-N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]pyridine-2-carboxamide is Cc1cccc(C(=O)NCc2ccc(N3CCOC(C)C3)nc2)n1.
What is the InChIKey of 6-methyl-N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]pyridine-2-carboxamide?
The InChIKey is YKCRKMYFYAXLIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N4O2/c1-13-4-3-5-16(21-13)18(23)20-11-15-6-7-17(19-10-15)22-8-9-24-14(2)12-22/h3-7,10,14H,8-9,11-12H2,1-2H3,(H,20,23).
What are the key properties of 6-methyl-N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]pyridine-2-carboxamide?
6-methyl-N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]pyridine-2-carboxamide has a molecular weight of 326.40 g/mol, XLogP of 1.94, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]pyridine-2-carboxamide is sourced from PubChem (CID 51080809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).