[6-[(1-methylpiperidin-2-yl)methoxy]-2-pyridinyl]methanamine

C13H21N3O — CID 65471873

IUPAC[6-[(1-methylpiperidin-2-yl)methoxy]-2-pyridinyl]methanamine
SMILESCN1CCCCC1COc1cccc(CN)n1
InChIInChI=1S/C13H21N3O/c1-16-8-3-2-6-12(16)10-17-13-7-4-5-11(9-14)15-13/h4-5,7,12H,2-3,6,8-10,14H2,1H3
InChIKeySZLFNEKJSNGVFW-UHFFFAOYSA-N
MW235.33 g/mol
LogP1.40
Rot. Bonds4

About [6-[(1-methylpiperidin-2-yl)methoxy]-2-pyridinyl]methanamine

[6-[(1-methylpiperidin-2-yl)methoxy]-2-pyridinyl]methanamine (PubChem CID 65471873) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is [6-[(1-methylpiperidin-2-yl)methoxy]-2-pyridinyl]methanamine.

Molecular Properties

Compound Name[6-[(1-methylpiperidin-2-yl)methoxy]-2-pyridinyl]methanamine
PubChem CID65471873
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC Name[6-[(1-methylpiperidin-2-yl)methoxy]-2-pyridinyl]methanamine
SMILESCN1CCCCC1COc1cccc(CN)n1
InChIInChI=1S/C13H21N3O/c1-16-8-3-2-6-12(16)10-17-13-7-4-5-11(9-14)15-13/h4-5,7,12H,2-3,6,8-10,14H2,1H3
InChIKeySZLFNEKJSNGVFW-UHFFFAOYSA-N
XLogP1.40
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [6-[(1-methylpiperidin-2-yl)methoxy]-2-pyridinyl]methanamine?
The IUPAC name of [6-[(1-methylpiperidin-2-yl)methoxy]-2-pyridinyl]methanamine (CID 65471873) is [6-[(1-methylpiperidin-2-yl)methoxy]-2-pyridinyl]methanamine.
What is the SMILES notation for [6-[(1-methylpiperidin-2-yl)methoxy]-2-pyridinyl]methanamine?
The canonical SMILES for [6-[(1-methylpiperidin-2-yl)methoxy]-2-pyridinyl]methanamine is CN1CCCCC1COc1cccc(CN)n1.
What is the InChIKey of [6-[(1-methylpiperidin-2-yl)methoxy]-2-pyridinyl]methanamine?
The InChIKey is SZLFNEKJSNGVFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-16-8-3-2-6-12(16)10-17-13-7-4-5-11(9-14)15-13/h4-5,7,12H,2-3,6,8-10,14H2,1H3.
What are the key properties of [6-[(1-methylpiperidin-2-yl)methoxy]-2-pyridinyl]methanamine?
[6-[(1-methylpiperidin-2-yl)methoxy]-2-pyridinyl]methanamine has a molecular weight of 235.33 g/mol, XLogP of 1.40, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[(1-methylpiperidin-2-yl)methoxy]-2-pyridinyl]methanamine is sourced from PubChem (CID 65471873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).