6-amino-N-methyl-N-(oxan-3-ylmethyl)pyridine-3-carboxamide

C13H19N3O2 — CID 63706952

IUPAC6-amino-N-methyl-N-(oxan-3-ylmethyl)pyridine-3-carboxamide
SMILESCN(CC1CCCOC1)C(=O)c1ccc(N)nc1
InChIInChI=1S/C13H19N3O2/c1-16(8-10-3-2-6-18-9-10)13(17)11-4-5-12(14)15-7-11/h4-5,7,10H,2-3,6,8-9H2,1H3,(H2,14,15)
InChIKeySOFPEENZOKTRPL-UHFFFAOYSA-N
MW249.31 g/mol
LogP1.16
Rot. Bonds3

About 6-amino-N-methyl-N-(oxan-3-ylmethyl)pyridine-3-carboxamide

6-amino-N-methyl-N-(oxan-3-ylmethyl)pyridine-3-carboxamide (PubChem CID 63706952) has the molecular formula C13H19N3O2 and a molecular weight of 249.31 g/mol. Its IUPAC name is 6-amino-N-methyl-N-(oxan-3-ylmethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-amino-N-methyl-N-(oxan-3-ylmethyl)pyridine-3-carboxamide
PubChem CID63706952
Molecular FormulaC13H19N3O2
Molecular Weight249.31 g/mol
Exact Mass249.15
IUPAC Name6-amino-N-methyl-N-(oxan-3-ylmethyl)pyridine-3-carboxamide
SMILESCN(CC1CCCOC1)C(=O)c1ccc(N)nc1
InChIInChI=1S/C13H19N3O2/c1-16(8-10-3-2-6-18-9-10)13(17)11-4-5-12(14)15-7-11/h4-5,7,10H,2-3,6,8-9H2,1H3,(H2,14,15)
InChIKeySOFPEENZOKTRPL-UHFFFAOYSA-N
XLogP1.16
TPSA68.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-chloro-N-methyl-N-(oxan-3-ylmethyl)pyridine-3-carboxamide
CID 63711414
4-acetyl-N-methyl-N-(oxan-3-ylmethyl)benzamide
CID 75370788
N-methyl-N-(oxan-3-ylmethyl)-4-sulfanylbenzamide
CID 107030003
3,5-diamino-N-methyl-N-(oxan-3-ylmethyl)benzamide
CID 55225636
5-amino-N-methyl-N-(oxan-3-ylmethyl)pyridine-2-carboxamide
CID 81315949
3-amino-4-bromo-N-methyl-N-(oxan-3-ylmethyl)benzamide
CID 63727084
4-amino-N,6-dimethyl-N-(oxan-3-ylmethyl)pyridine-3-carboxamide
CID 81241215
3-amino-4-ethoxy-N-methyl-N-(oxan-3-ylmethyl)benzamide
CID 63725532
3-chloro-4-hydroxy-N-methyl-N-(oxan-3-ylmethyl)benzamide
CID 63706362
2-amino-3-fluoro-N-methyl-N-(oxan-3-ylmethyl)pyridine-4-carboxamide
CID 105386353
2-amino-N-methyl-N-(oxan-3-ylmethyl)benzamide;hydrochloride
CID 119945322
3-hydroxy-4-methoxy-N-methyl-N-(oxan-3-ylmethyl)benzamide
CID 79673553

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-methyl-N-(oxan-3-ylmethyl)pyridine-3-carboxamide?
The IUPAC name of 6-amino-N-methyl-N-(oxan-3-ylmethyl)pyridine-3-carboxamide (CID 63706952) is 6-amino-N-methyl-N-(oxan-3-ylmethyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-amino-N-methyl-N-(oxan-3-ylmethyl)pyridine-3-carboxamide?
The canonical SMILES for 6-amino-N-methyl-N-(oxan-3-ylmethyl)pyridine-3-carboxamide is CN(CC1CCCOC1)C(=O)c1ccc(N)nc1.
What is the InChIKey of 6-amino-N-methyl-N-(oxan-3-ylmethyl)pyridine-3-carboxamide?
The InChIKey is SOFPEENZOKTRPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O2/c1-16(8-10-3-2-6-18-9-10)13(17)11-4-5-12(14)15-7-11/h4-5,7,10H,2-3,6,8-9H2,1H3,(H2,14,15).
What are the key properties of 6-amino-N-methyl-N-(oxan-3-ylmethyl)pyridine-3-carboxamide?
6-amino-N-methyl-N-(oxan-3-ylmethyl)pyridine-3-carboxamide has a molecular weight of 249.31 g/mol, XLogP of 1.16, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-methyl-N-(oxan-3-ylmethyl)pyridine-3-carboxamide is sourced from PubChem (CID 63706952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).