1-(1-methylpiperidin-4-yl)pyridin-2-imine

C11H17N3 — CID 89135049

IUPAC1-(1-methylpiperidin-4-yl)pyridin-2-imine
SMILES[H]/N=c1\ccccn1C1CCN(C)CC1
InChIInChI=1S/C11H17N3/c1-13-8-5-10(6-9-13)14-7-3-2-4-11(14)12/h2-4,7,10,12H,5-6,8-9H2,1H3/b12-11+
InChIKeyKOQOAEZPFWYVED-VAWYXSNFSA-N
MW191.28 g/mol
LogP1.23
Rot. Bonds1

About 1-(1-methylpiperidin-4-yl)pyridin-2-imine

1-(1-methylpiperidin-4-yl)pyridin-2-imine (PubChem CID 89135049) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is 1-(1-methylpiperidin-4-yl)pyridin-2-imine.

Molecular Properties

Compound Name1-(1-methylpiperidin-4-yl)pyridin-2-imine
PubChem CID89135049
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name1-(1-methylpiperidin-4-yl)pyridin-2-imine
SMILES[H]/N=c1\ccccn1C1CCN(C)CC1
InChIInChI=1S/C11H17N3/c1-13-8-5-10(6-9-13)14-7-3-2-4-11(14)12/h2-4,7,10,12H,5-6,8-9H2,1H3/b12-11+
InChIKeyKOQOAEZPFWYVED-VAWYXSNFSA-N
XLogP1.23
TPSA32.02 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(1-methylpiperidin-4-yl)pyridin-2-imine?
The IUPAC name of 1-(1-methylpiperidin-4-yl)pyridin-2-imine (CID 89135049) is 1-(1-methylpiperidin-4-yl)pyridin-2-imine.
What is the SMILES notation for 1-(1-methylpiperidin-4-yl)pyridin-2-imine?
The canonical SMILES for 1-(1-methylpiperidin-4-yl)pyridin-2-imine is [H]/N=c1\ccccn1C1CCN(C)CC1.
What is the InChIKey of 1-(1-methylpiperidin-4-yl)pyridin-2-imine?
The InChIKey is KOQOAEZPFWYVED-VAWYXSNFSA-N. The full InChI is InChI=1S/C11H17N3/c1-13-8-5-10(6-9-13)14-7-3-2-4-11(14)12/h2-4,7,10,12H,5-6,8-9H2,1H3/b12-11+.
What are the key properties of 1-(1-methylpiperidin-4-yl)pyridin-2-imine?
1-(1-methylpiperidin-4-yl)pyridin-2-imine has a molecular weight of 191.28 g/mol, XLogP of 1.23, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methylpiperidin-4-yl)pyridin-2-imine is sourced from PubChem (CID 89135049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).