[4-(3-methoxypiperidin-1-yl)-2-pyridinyl]methanamine

C12H19N3O — CID 102955936

IUPAC[4-(3-methoxypiperidin-1-yl)-2-pyridinyl]methanamine
SMILESCOC1CCCN(c2ccnc(CN)c2)C1
InChIInChI=1S/C12H19N3O/c1-16-12-3-2-6-15(9-12)11-4-5-14-10(7-11)8-13/h4-5,7,12H,2-3,6,8-9,13H2,1H3
InChIKeyIRHWXTMALUCICJ-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.16
Rot. Bonds3

About [4-(3-methoxypiperidin-1-yl)-2-pyridinyl]methanamine

[4-(3-methoxypiperidin-1-yl)-2-pyridinyl]methanamine (PubChem CID 102955936) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is [4-(3-methoxypiperidin-1-yl)-2-pyridinyl]methanamine.

Molecular Properties

Compound Name[4-(3-methoxypiperidin-1-yl)-2-pyridinyl]methanamine
PubChem CID102955936
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name[4-(3-methoxypiperidin-1-yl)-2-pyridinyl]methanamine
SMILESCOC1CCCN(c2ccnc(CN)c2)C1
InChIInChI=1S/C12H19N3O/c1-16-12-3-2-6-15(9-12)11-4-5-14-10(7-11)8-13/h4-5,7,12H,2-3,6,8-9,13H2,1H3
InChIKeyIRHWXTMALUCICJ-UHFFFAOYSA-N
XLogP1.16
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(3R)-3-methoxypiperidin-1-yl]pyridin-4-amine
CID 129413992
[4-(3,4-dimethylpyrrolidin-1-yl)-2-pyridinyl]methanamine
CID 79182680
[4-(3-methoxypiperidin-1-yl)-2-pyridinyl]-morpholin-4-ylmethanone
CID 56886009
[4-(4,4-dimethylazepan-1-yl)-2-pyridinyl]methanamine
CID 65283213
[4-(4-methoxypiperidin-1-yl)-2-pyridinyl]methanol
CID 61257075
1-[2-(aminomethyl)-4-pyridinyl]pyrrolidine-3,4-diol
CID 106667686
3-methoxy-1-phenylpiperidine
CID 70382121
[2-(3-methoxypyrrolidin-1-yl)pyrimidin-4-yl]methanamine
CID 107542321
4-(3-methoxypyrrolidin-1-yl)-N-methylpyridin-2-amine
CID 103541733
[4-(4-tert-butylpiperidin-1-yl)-2-pyridinyl]methanamine
CID 62298748
3-methoxy-1-(4-methylphenyl)piperidine
CID 167437498
N'-hydroxy-4-(3-methoxypyrrolidin-1-yl)pyridine-2-carboximidamide
CID 136967839

Frequently Asked Questions

What is the IUPAC name of [4-(3-methoxypiperidin-1-yl)-2-pyridinyl]methanamine?
The IUPAC name of [4-(3-methoxypiperidin-1-yl)-2-pyridinyl]methanamine (CID 102955936) is [4-(3-methoxypiperidin-1-yl)-2-pyridinyl]methanamine.
What is the SMILES notation for [4-(3-methoxypiperidin-1-yl)-2-pyridinyl]methanamine?
The canonical SMILES for [4-(3-methoxypiperidin-1-yl)-2-pyridinyl]methanamine is COC1CCCN(c2ccnc(CN)c2)C1.
What is the InChIKey of [4-(3-methoxypiperidin-1-yl)-2-pyridinyl]methanamine?
The InChIKey is IRHWXTMALUCICJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-16-12-3-2-6-15(9-12)11-4-5-14-10(7-11)8-13/h4-5,7,12H,2-3,6,8-9,13H2,1H3.
What are the key properties of [4-(3-methoxypiperidin-1-yl)-2-pyridinyl]methanamine?
[4-(3-methoxypiperidin-1-yl)-2-pyridinyl]methanamine has a molecular weight of 221.30 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 [4-(3-methoxypiperidin-1-yl)-2-pyridinyl]methanamine is sourced from PubChem (CID 102955936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).