[1-[(1-methylpiperidin-2-yl)methyl]-2H-pyridin-6-yl]methanamine

C13H23N3 — CID 68931925

IUPAC[1-[(1-methylpiperidin-2-yl)methyl]-2H-pyridin-6-yl]methanamine
SMILESCN1CCCCC1CN1CC=CC=C1CN
InChIInChI=1S/C13H23N3/c1-15-8-4-2-7-13(15)11-16-9-5-3-6-12(16)10-14/h3,5-6,13H,2,4,7-11,14H2,1H3
InChIKeyGXSGQLBBYGYLOK-UHFFFAOYSA-N
MW221.35 g/mol
LogP1.19
Rot. Bonds3

About [1-[(1-methylpiperidin-2-yl)methyl]-2H-pyridin-6-yl]methanamine

[1-[(1-methylpiperidin-2-yl)methyl]-2H-pyridin-6-yl]methanamine (PubChem CID 68931925) has the molecular formula C13H23N3 and a molecular weight of 221.35 g/mol. Its IUPAC name is [1-[(1-methylpiperidin-2-yl)methyl]-2H-pyridin-6-yl]methanamine.

Molecular Properties

Compound Name[1-[(1-methylpiperidin-2-yl)methyl]-2H-pyridin-6-yl]methanamine
PubChem CID68931925
Molecular FormulaC13H23N3
Molecular Weight221.35 g/mol
Exact Mass221.19
IUPAC Name[1-[(1-methylpiperidin-2-yl)methyl]-2H-pyridin-6-yl]methanamine
SMILESCN1CCCCC1CN1CC=CC=C1CN
InChIInChI=1S/C13H23N3/c1-15-8-4-2-7-13(15)11-16-9-5-3-6-12(16)10-14/h3,5-6,13H,2,4,7-11,14H2,1H3
InChIKeyGXSGQLBBYGYLOK-UHFFFAOYSA-N
XLogP1.19
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.35
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1-[(1-methylpiperidin-2-yl)methyl]-2H-pyridin-6-yl]methanamine?
The IUPAC name of [1-[(1-methylpiperidin-2-yl)methyl]-2H-pyridin-6-yl]methanamine (CID 68931925) is [1-[(1-methylpiperidin-2-yl)methyl]-2H-pyridin-6-yl]methanamine.
What is the SMILES notation for [1-[(1-methylpiperidin-2-yl)methyl]-2H-pyridin-6-yl]methanamine?
The canonical SMILES for [1-[(1-methylpiperidin-2-yl)methyl]-2H-pyridin-6-yl]methanamine is CN1CCCCC1CN1CC=CC=C1CN.
What is the InChIKey of [1-[(1-methylpiperidin-2-yl)methyl]-2H-pyridin-6-yl]methanamine?
The InChIKey is GXSGQLBBYGYLOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3/c1-15-8-4-2-7-13(15)11-16-9-5-3-6-12(16)10-14/h3,5-6,13H,2,4,7-11,14H2,1H3.
What are the key properties of [1-[(1-methylpiperidin-2-yl)methyl]-2H-pyridin-6-yl]methanamine?
[1-[(1-methylpiperidin-2-yl)methyl]-2H-pyridin-6-yl]methanamine has a molecular weight of 221.35 g/mol, XLogP of 1.19, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(1-methylpiperidin-2-yl)methyl]-2H-pyridin-6-yl]methanamine is sourced from PubChem (CID 68931925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).