4-[2-(aminomethyl)-4-methoxypiperidin-1-yl]-2,6-dimethylpyridine-3-carboxamide

C15H24N4O2 — CID 115963834

IUPAC4-[2-(aminomethyl)-4-methoxypiperidin-1-yl]-2,6-dimethylpyridine-3-carboxamide
SMILESCOC1CCN(c2cc(C)nc(C)c2C(N)=O)C(CN)C1
InChIInChI=1S/C15H24N4O2/c1-9-6-13(14(15(17)20)10(2)18-9)19-5-4-12(21-3)7-11(19)8-16/h6,11-12H,4-5,7-8,16H2,1-3H3,(H2,17,20)
InChIKeyJEIUQEHMMQJTMT-UHFFFAOYSA-N
MW292.38 g/mol
LogP0.74
Rot. Bonds4

About 4-[2-(aminomethyl)-4-methoxypiperidin-1-yl]-2,6-dimethylpyridine-3-carboxamide

4-[2-(aminomethyl)-4-methoxypiperidin-1-yl]-2,6-dimethylpyridine-3-carboxamide (PubChem CID 115963834) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is 4-[2-(aminomethyl)-4-methoxypiperidin-1-yl]-2,6-dimethylpyridine-3-carboxamide.

Molecular Properties

Compound Name4-[2-(aminomethyl)-4-methoxypiperidin-1-yl]-2,6-dimethylpyridine-3-carboxamide
PubChem CID115963834
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC Name4-[2-(aminomethyl)-4-methoxypiperidin-1-yl]-2,6-dimethylpyridine-3-carboxamide
SMILESCOC1CCN(c2cc(C)nc(C)c2C(N)=O)C(CN)C1
InChIInChI=1S/C15H24N4O2/c1-9-6-13(14(15(17)20)10(2)18-9)19-5-4-12(21-3)7-11(19)8-16/h6,11-12H,4-5,7-8,16H2,1-3H3,(H2,17,20)
InChIKeyJEIUQEHMMQJTMT-UHFFFAOYSA-N
XLogP0.74
TPSA94.47 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 50.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-[2-(aminomethyl)piperidin-1-yl]-2,6-dimethylpyridine-3-carboxamide
CID 81051866
6-[2-(aminomethyl)-4-methoxypiperidin-1-yl]pyridine-2-carboxamide
CID 112622854
2-[1-(3-carbamoyl-2,6-dimethyl-4-pyridinyl)pyrrolidin-2-yl]acetic acid
CID 81050331
2,6-dimethyl-4-[2-(methylaminomethyl)piperidin-1-yl]pyridine-3-carboxamide
CID 81052481
[2-(aminomethyl)-4-methoxypiperidin-1-yl]-(3,6-dimethylpyridazin-4-yl)methanone
CID 104671747
[2-(aminomethyl)-4-methoxypiperidin-1-yl]-(2,4,6-trimethylphenyl)methanone
CID 115963404
[4-methoxy-1-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperidin-2-yl]methanamine
CID 115963984
[2-(aminomethyl)-4-methoxypiperidin-1-yl]-(2,4-dimethyl-1,3-oxazol-5-yl)methanone
CID 112622301
2,6-dimethyl-4-piperazin-1-ylpyridine-3-carboxamide
CID 81050845
4-(3-amino-8-azabicyclo[3.2.1]octan-8-yl)-2,6-dimethylpyridine-3-carboxamide
CID 81052090
5-[2-(aminomethyl)-4-methoxypiperidin-1-yl]-4-bromo-2-methylpyridazin-3-one
CID 114447138
[2-(aminomethyl)-4-methoxypiperidin-1-yl]-(3,5-dimethyl-1H-pyrazol-4-yl)methanone
CID 112622199

Frequently Asked Questions

What is the IUPAC name of 4-[2-(aminomethyl)-4-methoxypiperidin-1-yl]-2,6-dimethylpyridine-3-carboxamide?
The IUPAC name of 4-[2-(aminomethyl)-4-methoxypiperidin-1-yl]-2,6-dimethylpyridine-3-carboxamide (CID 115963834) is 4-[2-(aminomethyl)-4-methoxypiperidin-1-yl]-2,6-dimethylpyridine-3-carboxamide.
What is the SMILES notation for 4-[2-(aminomethyl)-4-methoxypiperidin-1-yl]-2,6-dimethylpyridine-3-carboxamide?
The canonical SMILES for 4-[2-(aminomethyl)-4-methoxypiperidin-1-yl]-2,6-dimethylpyridine-3-carboxamide is COC1CCN(c2cc(C)nc(C)c2C(N)=O)C(CN)C1.
What is the InChIKey of 4-[2-(aminomethyl)-4-methoxypiperidin-1-yl]-2,6-dimethylpyridine-3-carboxamide?
The InChIKey is JEIUQEHMMQJTMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-9-6-13(14(15(17)20)10(2)18-9)19-5-4-12(21-3)7-11(19)8-16/h6,11-12H,4-5,7-8,16H2,1-3H3,(H2,17,20).
What are the key properties of 4-[2-(aminomethyl)-4-methoxypiperidin-1-yl]-2,6-dimethylpyridine-3-carboxamide?
4-[2-(aminomethyl)-4-methoxypiperidin-1-yl]-2,6-dimethylpyridine-3-carboxamide has a molecular weight of 292.38 g/mol, XLogP of 0.74, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(aminomethyl)-4-methoxypiperidin-1-yl]-2,6-dimethylpyridine-3-carboxamide is sourced from PubChem (CID 115963834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).