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

C15H24N4O2 — CID 115963854

IUPAC6-[2-(aminomethyl)-4-methoxypiperidin-1-yl]-N,N-dimethylpyridine-3-carboxamide
SMILESCOC1CCN(c2ccc(C(=O)N(C)C)cn2)C(CN)C1
InChIInChI=1S/C15H24N4O2/c1-18(2)15(20)11-4-5-14(17-10-11)19-7-6-13(21-3)8-12(19)9-16/h4-5,10,12-13H,6-9,16H2,1-3H3
InChIKeyZUKVYPVZQHZWND-UHFFFAOYSA-N
MW292.38 g/mol
LogP0.73
Rot. Bonds4

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

6-[2-(aminomethyl)-4-methoxypiperidin-1-yl]-N,N-dimethylpyridine-3-carboxamide (PubChem CID 115963854) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is 6-[2-(aminomethyl)-4-methoxypiperidin-1-yl]-N,N-dimethylpyridine-3-carboxamide.

Molecular Properties

Compound Name6-[2-(aminomethyl)-4-methoxypiperidin-1-yl]-N,N-dimethylpyridine-3-carboxamide
PubChem CID115963854
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC Name6-[2-(aminomethyl)-4-methoxypiperidin-1-yl]-N,N-dimethylpyridine-3-carboxamide
SMILESCOC1CCN(c2ccc(C(=O)N(C)C)cn2)C(CN)C1
InChIInChI=1S/C15H24N4O2/c1-18(2)15(20)11-4-5-14(17-10-11)19-7-6-13(21-3)8-12(19)9-16/h4-5,10,12-13H,6-9,16H2,1-3H3
InChIKeyZUKVYPVZQHZWND-UHFFFAOYSA-N
XLogP0.73
TPSA71.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[4-methoxy-1-(5-methoxy-2-pyridinyl)piperidin-2-yl]methanamine
CID 106504519
(4-methoxy-1-pyridin-2-ylpiperidin-2-yl)methanamine
CID 112622846
6-[4-(2-aminoethoxy)piperidin-1-yl]-N,N-dimethylpyridine-3-carboxamide
CID 82688178
6-[2-(aminomethyl)-4-methoxypiperidin-1-yl]pyridine-2-carboxamide
CID 112622854
6-[2-(hydroxymethyl)azepan-1-yl]-N,N-dimethylpyridine-3-carboxamide
CID 116637062
[1-(6-chloropyridazin-3-yl)-4-methoxypiperidin-2-yl]methanamine
CID 112622877
[4-methoxy-1-(6-methoxypyrimidin-4-yl)piperidin-2-yl]methanamine
CID 112622803
ethyl 6-(2-ethylpiperidin-1-yl)pyridine-3-carboxylate
CID 103613521
6-[3-(2-aminoethyl)pyrrolidin-1-yl]-N,N-dimethylpyridine-3-carboxamide
CID 114802345
[4-methoxy-1-(6-propan-2-ylpyrimidin-4-yl)piperidin-2-yl]methanamine
CID 112622870
2-[1-(5-ethoxycarbonyl-2-pyridinyl)pyrrolidin-2-yl]acetic acid
CID 61370312
6-[(2R)-2-(methoxymethyl)pyrrolidin-1-yl]pyridine-3-carboxylic acid
CID 129495333

Frequently Asked Questions

What is the IUPAC name of 6-[2-(aminomethyl)-4-methoxypiperidin-1-yl]-N,N-dimethylpyridine-3-carboxamide?
The IUPAC name of 6-[2-(aminomethyl)-4-methoxypiperidin-1-yl]-N,N-dimethylpyridine-3-carboxamide (CID 115963854) is 6-[2-(aminomethyl)-4-methoxypiperidin-1-yl]-N,N-dimethylpyridine-3-carboxamide.
What is the SMILES notation for 6-[2-(aminomethyl)-4-methoxypiperidin-1-yl]-N,N-dimethylpyridine-3-carboxamide?
The canonical SMILES for 6-[2-(aminomethyl)-4-methoxypiperidin-1-yl]-N,N-dimethylpyridine-3-carboxamide is COC1CCN(c2ccc(C(=O)N(C)C)cn2)C(CN)C1.
What is the InChIKey of 6-[2-(aminomethyl)-4-methoxypiperidin-1-yl]-N,N-dimethylpyridine-3-carboxamide?
The InChIKey is ZUKVYPVZQHZWND-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-18(2)15(20)11-4-5-14(17-10-11)19-7-6-13(21-3)8-12(19)9-16/h4-5,10,12-13H,6-9,16H2,1-3H3.
What are the key properties of 6-[2-(aminomethyl)-4-methoxypiperidin-1-yl]-N,N-dimethylpyridine-3-carboxamide?
6-[2-(aminomethyl)-4-methoxypiperidin-1-yl]-N,N-dimethylpyridine-3-carboxamide has a molecular weight of 292.38 g/mol, XLogP of 0.73, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(aminomethyl)-4-methoxypiperidin-1-yl]-N,N-dimethylpyridine-3-carboxamide is sourced from PubChem (CID 115963854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).