1-methyl-N-pyridin-3-ylpiperidin-4-imine

C11H15N3 — CID 10631510

IUPAC1-methyl-N-pyridin-3-ylpiperidin-4-imine
SMILESCN1CCC(=Nc2cccnc2)CC1
InChIInChI=1S/C11H15N3/c1-14-7-4-10(5-8-14)13-11-3-2-6-12-9-11/h2-3,6,9H,4-5,7-8H2,1H3
InChIKeyVEORAHHTSRWFKF-UHFFFAOYSA-N
MW189.26 g/mol
LogP1.88
Rot. Bonds1

About 1-methyl-N-pyridin-3-ylpiperidin-4-imine

1-methyl-N-pyridin-3-ylpiperidin-4-imine (PubChem CID 10631510) has the molecular formula C11H15N3 and a molecular weight of 189.26 g/mol. Its IUPAC name is 1-methyl-N-pyridin-3-ylpiperidin-4-imine.

Molecular Properties

Compound Name1-methyl-N-pyridin-3-ylpiperidin-4-imine
PubChem CID10631510
Molecular FormulaC11H15N3
Molecular Weight189.26 g/mol
Exact Mass189.13
IUPAC Name1-methyl-N-pyridin-3-ylpiperidin-4-imine
SMILESCN1CCC(=Nc2cccnc2)CC1
InChIInChI=1S/C11H15N3/c1-14-7-4-10(5-8-14)13-11-3-2-6-12-9-11/h2-3,6,9H,4-5,7-8H2,1H3
InChIKeyVEORAHHTSRWFKF-UHFFFAOYSA-N
XLogP1.88
TPSA28.49 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 51.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

Pyridine
CID 1049
3,4-Diaminopyridine
CID 5918
2,2'-Bipyridine
CID 1474
Pralidoxime Chloride
CID 135445761
Diquat
CID 6795
2-Methylpyridine
CID 7975
5,5'-Dimethyl-2,2'-bipyridyl
CID 15664
2-Vinylpyridine
CID 7521
Quinoxaline
CID 7045
Pralidoxime
CID 135398747
2-Propylpyridine
CID 69320
3-Aminopyridine
CID 10009

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-pyridin-3-ylpiperidin-4-imine?
The IUPAC name of 1-methyl-N-pyridin-3-ylpiperidin-4-imine (CID 10631510) is 1-methyl-N-pyridin-3-ylpiperidin-4-imine.
What is the SMILES notation for 1-methyl-N-pyridin-3-ylpiperidin-4-imine?
The canonical SMILES for 1-methyl-N-pyridin-3-ylpiperidin-4-imine is CN1CCC(=Nc2cccnc2)CC1.
What is the InChIKey of 1-methyl-N-pyridin-3-ylpiperidin-4-imine?
The InChIKey is VEORAHHTSRWFKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3/c1-14-7-4-10(5-8-14)13-11-3-2-6-12-9-11/h2-3,6,9H,4-5,7-8H2,1H3.
What are the key properties of 1-methyl-N-pyridin-3-ylpiperidin-4-imine?
1-methyl-N-pyridin-3-ylpiperidin-4-imine has a molecular weight of 189.26 g/mol, XLogP of 1.88, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-pyridin-3-ylpiperidin-4-imine is sourced from PubChem (CID 10631510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).