1-(4-methyl-3-pyridinyl)piperidin-2-imine

C11H15N3 — CID 63327173

IUPAC1-(4-methyl-3-pyridinyl)piperidin-2-imine
SMILES[H]/N=C1\CCCCN1c1cnccc1C
InChIInChI=1S/C11H15N3/c1-9-5-6-13-8-10(9)14-7-3-2-4-11(14)12/h5-6,8,12H,2-4,7H2,1H3/b12-11+
InChIKeyRAJTVYOCIMKWIA-VAWYXSNFSA-N
MW189.26 g/mol
LogP2.36
Rot. Bonds1

About 1-(4-methyl-3-pyridinyl)piperidin-2-imine

1-(4-methyl-3-pyridinyl)piperidin-2-imine (PubChem CID 63327173) has the molecular formula C11H15N3 and a molecular weight of 189.26 g/mol. Its IUPAC name is 1-(4-methyl-3-pyridinyl)piperidin-2-imine.

Molecular Properties

Compound Name1-(4-methyl-3-pyridinyl)piperidin-2-imine
PubChem CID63327173
Molecular FormulaC11H15N3
Molecular Weight189.26 g/mol
Exact Mass189.13
IUPAC Name1-(4-methyl-3-pyridinyl)piperidin-2-imine
SMILES[H]/N=C1\CCCCN1c1cnccc1C
InChIInChI=1S/C11H15N3/c1-9-5-6-13-8-10(9)14-7-3-2-4-11(14)12/h5-6,8,12H,2-4,7H2,1H3/b12-11+
InChIKeyRAJTVYOCIMKWIA-VAWYXSNFSA-N
XLogP2.36
TPSA39.98 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(4-methyl-3-pyridinyl)piperidin-2-imine?
The IUPAC name of 1-(4-methyl-3-pyridinyl)piperidin-2-imine (CID 63327173) is 1-(4-methyl-3-pyridinyl)piperidin-2-imine.
What is the SMILES notation for 1-(4-methyl-3-pyridinyl)piperidin-2-imine?
The canonical SMILES for 1-(4-methyl-3-pyridinyl)piperidin-2-imine is [H]/N=C1\CCCCN1c1cnccc1C.
What is the InChIKey of 1-(4-methyl-3-pyridinyl)piperidin-2-imine?
The InChIKey is RAJTVYOCIMKWIA-VAWYXSNFSA-N. The full InChI is InChI=1S/C11H15N3/c1-9-5-6-13-8-10(9)14-7-3-2-4-11(14)12/h5-6,8,12H,2-4,7H2,1H3/b12-11+.
What are the key properties of 1-(4-methyl-3-pyridinyl)piperidin-2-imine?
1-(4-methyl-3-pyridinyl)piperidin-2-imine has a molecular weight of 189.26 g/mol, XLogP of 2.36, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methyl-3-pyridinyl)piperidin-2-imine is sourced from PubChem (CID 63327173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).