5-amino-N-methyl-N-(oxan-2-ylmethyl)pyridine-2-carboxamide

C13H19N3O2 — CID 81315666

IUPAC5-amino-N-methyl-N-(oxan-2-ylmethyl)pyridine-2-carboxamide
SMILESCN(CC1CCCCO1)C(=O)c1ccc(N)cn1
InChIInChI=1S/C13H19N3O2/c1-16(9-11-4-2-3-7-18-11)13(17)12-6-5-10(14)8-15-12/h5-6,8,11H,2-4,7,9,14H2,1H3
InChIKeyPKJXUXMOYAOCJO-UHFFFAOYSA-N
MW249.31 g/mol
LogP1.30
Rot. Bonds3

About 5-amino-N-methyl-N-(oxan-2-ylmethyl)pyridine-2-carboxamide

5-amino-N-methyl-N-(oxan-2-ylmethyl)pyridine-2-carboxamide (PubChem CID 81315666) has the molecular formula C13H19N3O2 and a molecular weight of 249.31 g/mol. Its IUPAC name is 5-amino-N-methyl-N-(oxan-2-ylmethyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-amino-N-methyl-N-(oxan-2-ylmethyl)pyridine-2-carboxamide
PubChem CID81315666
Molecular FormulaC13H19N3O2
Molecular Weight249.31 g/mol
Exact Mass249.15
IUPAC Name5-amino-N-methyl-N-(oxan-2-ylmethyl)pyridine-2-carboxamide
SMILESCN(CC1CCCCO1)C(=O)c1ccc(N)cn1
InChIInChI=1S/C13H19N3O2/c1-16(9-11-4-2-3-7-18-11)13(17)12-6-5-10(14)8-15-12/h5-6,8,11H,2-4,7,9,14H2,1H3
InChIKeyPKJXUXMOYAOCJO-UHFFFAOYSA-N
XLogP1.30
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 ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N-methyl-N-(oxan-2-ylmethyl)benzamide;hydrochloride
CID 119746333
5-chloro-N-methyl-N-(oxan-2-ylmethyl)pyrazine-2-carboxamide
CID 107252486
5-amino-N-methyl-N-(oxan-3-ylmethyl)pyridine-2-carboxamide
CID 81315949
4-amino-N-methyl-N-(oxolan-2-ylmethyl)benzamide;hydrochloride
CID 119708774
5-(ethylamino)-N-methyl-N-(oxan-2-ylmethyl)pyrazine-2-carboxamide
CID 107374782
5-amino-2-chloro-N-methyl-N-(oxan-2-ylmethyl)benzamide
CID 61430467
N-methyl-N-[[(2R)-oxolan-2-yl]methyl]pyrimidine-4-carboxamide
CID 127943943
N-methyl-N-(oxan-2-ylmethyl)-1,3-thiazole-4-carboxamide
CID 55218707
N-methyl-N-[[(2S)-oxan-2-yl]methyl]-1,8-naphthyridine-2-carboxamide
CID 95189773
6-chloro-N-methyl-N-(oxan-2-ylmethyl)pyridine-2-carboxamide
CID 55052209
5-amino-N-methyl-N-(oxan-2-ylmethyl)-1H-pyrazole-4-carboxamide
CID 61435982
1-(5-amino-2-pyridinyl)-3-(oxolan-2-yl)propan-1-one
CID 116605212

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-methyl-N-(oxan-2-ylmethyl)pyridine-2-carboxamide?
The IUPAC name of 5-amino-N-methyl-N-(oxan-2-ylmethyl)pyridine-2-carboxamide (CID 81315666) is 5-amino-N-methyl-N-(oxan-2-ylmethyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-amino-N-methyl-N-(oxan-2-ylmethyl)pyridine-2-carboxamide?
The canonical SMILES for 5-amino-N-methyl-N-(oxan-2-ylmethyl)pyridine-2-carboxamide is CN(CC1CCCCO1)C(=O)c1ccc(N)cn1.
What is the InChIKey of 5-amino-N-methyl-N-(oxan-2-ylmethyl)pyridine-2-carboxamide?
The InChIKey is PKJXUXMOYAOCJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O2/c1-16(9-11-4-2-3-7-18-11)13(17)12-6-5-10(14)8-15-12/h5-6,8,11H,2-4,7,9,14H2,1H3.
What are the key properties of 5-amino-N-methyl-N-(oxan-2-ylmethyl)pyridine-2-carboxamide?
5-amino-N-methyl-N-(oxan-2-ylmethyl)pyridine-2-carboxamide has a molecular weight of 249.31 g/mol, XLogP of 1.30, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-methyl-N-(oxan-2-ylmethyl)pyridine-2-carboxamide is sourced from PubChem (CID 81315666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).