2-methyl-N-(morpholin-3-ylmethyl)pyridine-3-carboxamide

C12H17N3O2 — CID 103548430

IUPAC2-methyl-N-(morpholin-3-ylmethyl)pyridine-3-carboxamide
SMILESCc1ncccc1C(=O)NCC1COCCN1
InChIInChI=1S/C12H17N3O2/c1-9-11(3-2-4-13-9)12(16)15-7-10-8-17-6-5-14-10/h2-4,10,14H,5-8H2,1H3,(H,15,16)
InChIKeyTYKWGBHPHKYOOG-UHFFFAOYSA-N
MW235.29 g/mol
LogP0.11
Rot. Bonds3

About 2-methyl-N-(morpholin-3-ylmethyl)pyridine-3-carboxamide

2-methyl-N-(morpholin-3-ylmethyl)pyridine-3-carboxamide (PubChem CID 103548430) has the molecular formula C12H17N3O2 and a molecular weight of 235.29 g/mol. Its IUPAC name is 2-methyl-N-(morpholin-3-ylmethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-methyl-N-(morpholin-3-ylmethyl)pyridine-3-carboxamide
PubChem CID103548430
Molecular FormulaC12H17N3O2
Molecular Weight235.29 g/mol
Exact Mass235.13
IUPAC Name2-methyl-N-(morpholin-3-ylmethyl)pyridine-3-carboxamide
SMILESCc1ncccc1C(=O)NCC1COCCN1
InChIInChI=1S/C12H17N3O2/c1-9-11(3-2-4-13-9)12(16)15-7-10-8-17-6-5-14-10/h2-4,10,14H,5-8H2,1H3,(H,15,16)
InChIKeyTYKWGBHPHKYOOG-UHFFFAOYSA-N
XLogP0.11
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 50.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-methyl-N-(morpholin-3-ylmethyl)-1,2-oxazole-4-carboxamide
CID 103548403
3-ethyl-6-methyl-N-(morpholin-3-ylmethyl)pyridazine-4-carboxamide
CID 103548617
2-methyl-N-(pyrrolidin-3-ylmethyl)pyridine-3-carboxamide
CID 80564265
2-fluoro-6-hydroxy-N-(morpholin-3-ylmethyl)benzamide
CID 107016112
1,5-dimethyl-N-(morpholin-3-ylmethyl)pyrrole-2-carboxamide
CID 103548575
2-methyl-N-(morpholin-3-ylmethyl)-4-nitrobenzamide
CID 103548415
N-[(4-hydroxypyrrolidin-3-yl)methyl]-2-methylpyridine-3-carboxamide;dihydrochloride
CID 120944751
2-chloro-5-methylsulfanyl-N-(morpholin-3-ylmethyl)benzamide
CID 103548347
5-methyl-N-(morpholin-3-ylmethyl)-1,2,4-oxadiazole-3-carboxamide
CID 103548596
4-bromo-3-methyl-N-(morpholin-3-ylmethyl)benzamide
CID 103548613
4-fluoro-3-methyl-N-(morpholin-3-ylmethyl)benzamide
CID 103548729
4-bromo-2-fluoro-N-(morpholin-3-ylmethyl)benzamide
CID 103548342

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(morpholin-3-ylmethyl)pyridine-3-carboxamide?
The IUPAC name of 2-methyl-N-(morpholin-3-ylmethyl)pyridine-3-carboxamide (CID 103548430) is 2-methyl-N-(morpholin-3-ylmethyl)pyridine-3-carboxamide.
What is the SMILES notation for 2-methyl-N-(morpholin-3-ylmethyl)pyridine-3-carboxamide?
The canonical SMILES for 2-methyl-N-(morpholin-3-ylmethyl)pyridine-3-carboxamide is Cc1ncccc1C(=O)NCC1COCCN1.
What is the InChIKey of 2-methyl-N-(morpholin-3-ylmethyl)pyridine-3-carboxamide?
The InChIKey is TYKWGBHPHKYOOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O2/c1-9-11(3-2-4-13-9)12(16)15-7-10-8-17-6-5-14-10/h2-4,10,14H,5-8H2,1H3,(H,15,16).
What are the key properties of 2-methyl-N-(morpholin-3-ylmethyl)pyridine-3-carboxamide?
2-methyl-N-(morpholin-3-ylmethyl)pyridine-3-carboxamide has a molecular weight of 235.29 g/mol, XLogP of 0.11, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(morpholin-3-ylmethyl)pyridine-3-carboxamide is sourced from PubChem (CID 103548430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).