1-(1,4-dimethyl-3,6-dihydro-2H-pyridin-5-yl)-N-methylmethanimine

C9H16N2 — CID 139458500

IUPAC1-(1,4-dimethyl-3,6-dihydro-2H-pyridin-5-yl)-N-methylmethanimine
SMILESC/N=C/C1=C(C)CCN(C)C1
InChIInChI=1S/C9H16N2/c1-8-4-5-11(3)7-9(8)6-10-2/h6H,4-5,7H2,1-3H3/b10-6+
InChIKeyXIBJDIBBLKJART-UXBLZVDNSA-N
MW152.24 g/mol
LogP1.34
Rot. Bonds1

About 1-(1,4-dimethyl-3,6-dihydro-2H-pyridin-5-yl)-N-methylmethanimine

1-(1,4-dimethyl-3,6-dihydro-2H-pyridin-5-yl)-N-methylmethanimine (PubChem CID 139458500) has the molecular formula C9H16N2 and a molecular weight of 152.24 g/mol. Its IUPAC name is 1-(1,4-dimethyl-3,6-dihydro-2H-pyridin-5-yl)-N-methylmethanimine.

Molecular Properties

Compound Name1-(1,4-dimethyl-3,6-dihydro-2H-pyridin-5-yl)-N-methylmethanimine
PubChem CID139458500
Molecular FormulaC9H16N2
Molecular Weight152.24 g/mol
Exact Mass152.13
IUPAC Name1-(1,4-dimethyl-3,6-dihydro-2H-pyridin-5-yl)-N-methylmethanimine
SMILESC/N=C/C1=C(C)CCN(C)C1
InChIInChI=1S/C9H16N2/c1-8-4-5-11(3)7-9(8)6-10-2/h6H,4-5,7H2,1-3H3/b10-6+
InChIKeyXIBJDIBBLKJART-UXBLZVDNSA-N
XLogP1.34
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 51.34
H-Bond Donors ≤ 50
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-(1,4-dimethyl-3,6-dihydro-2H-pyridin-5-yl)-N-methylmethanimine?
The IUPAC name of 1-(1,4-dimethyl-3,6-dihydro-2H-pyridin-5-yl)-N-methylmethanimine (CID 139458500) is 1-(1,4-dimethyl-3,6-dihydro-2H-pyridin-5-yl)-N-methylmethanimine.
What is the SMILES notation for 1-(1,4-dimethyl-3,6-dihydro-2H-pyridin-5-yl)-N-methylmethanimine?
The canonical SMILES for 1-(1,4-dimethyl-3,6-dihydro-2H-pyridin-5-yl)-N-methylmethanimine is C/N=C/C1=C(C)CCN(C)C1.
What is the InChIKey of 1-(1,4-dimethyl-3,6-dihydro-2H-pyridin-5-yl)-N-methylmethanimine?
The InChIKey is XIBJDIBBLKJART-UXBLZVDNSA-N. The full InChI is InChI=1S/C9H16N2/c1-8-4-5-11(3)7-9(8)6-10-2/h6H,4-5,7H2,1-3H3/b10-6+.
What are the key properties of 1-(1,4-dimethyl-3,6-dihydro-2H-pyridin-5-yl)-N-methylmethanimine?
1-(1,4-dimethyl-3,6-dihydro-2H-pyridin-5-yl)-N-methylmethanimine has a molecular weight of 152.24 g/mol, XLogP of 1.34, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,4-dimethyl-3,6-dihydro-2H-pyridin-5-yl)-N-methylmethanimine is sourced from PubChem (CID 139458500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).