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

C9H16N2 — CID 170634493

IUPACN-(1,5-dimethyl-3,6-dihydro-2H-pyridin-4-yl)ethanimine
SMILESC/C=N/C1=C(C)CN(C)CC1
InChIInChI=1S/C9H16N2/c1-4-10-9-5-6-11(3)7-8(9)2/h4H,5-7H2,1-3H3/b10-4+
InChIKeyJYNNQXXQHQWBAU-ONNFQVAWSA-N
MW152.24 g/mol
LogP1.69
Rot. Bonds1

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

N-(1,5-dimethyl-3,6-dihydro-2H-pyridin-4-yl)ethanimine (PubChem CID 170634493) has the molecular formula C9H16N2 and a molecular weight of 152.24 g/mol. Its IUPAC name is N-(1,5-dimethyl-3,6-dihydro-2H-pyridin-4-yl)ethanimine.

Molecular Properties

Compound NameN-(1,5-dimethyl-3,6-dihydro-2H-pyridin-4-yl)ethanimine
PubChem CID170634493
Molecular FormulaC9H16N2
Molecular Weight152.24 g/mol
Exact Mass152.13
IUPAC NameN-(1,5-dimethyl-3,6-dihydro-2H-pyridin-4-yl)ethanimine
SMILESC/C=N/C1=C(C)CN(C)CC1
InChIInChI=1S/C9H16N2/c1-4-10-9-5-6-11(3)7-8(9)2/h4H,5-7H2,1-3H3/b10-4+
InChIKeyJYNNQXXQHQWBAU-ONNFQVAWSA-N
XLogP1.69
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 ≤ 51.69
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 N-(1,5-dimethyl-3,6-dihydro-2H-pyridin-4-yl)ethanimine?
The IUPAC name of N-(1,5-dimethyl-3,6-dihydro-2H-pyridin-4-yl)ethanimine (CID 170634493) is N-(1,5-dimethyl-3,6-dihydro-2H-pyridin-4-yl)ethanimine.
What is the SMILES notation for N-(1,5-dimethyl-3,6-dihydro-2H-pyridin-4-yl)ethanimine?
The canonical SMILES for N-(1,5-dimethyl-3,6-dihydro-2H-pyridin-4-yl)ethanimine is C/C=N/C1=C(C)CN(C)CC1.
What is the InChIKey of N-(1,5-dimethyl-3,6-dihydro-2H-pyridin-4-yl)ethanimine?
The InChIKey is JYNNQXXQHQWBAU-ONNFQVAWSA-N. The full InChI is InChI=1S/C9H16N2/c1-4-10-9-5-6-11(3)7-8(9)2/h4H,5-7H2,1-3H3/b10-4+.
What are the key properties of N-(1,5-dimethyl-3,6-dihydro-2H-pyridin-4-yl)ethanimine?
N-(1,5-dimethyl-3,6-dihydro-2H-pyridin-4-yl)ethanimine has a molecular weight of 152.24 g/mol, XLogP of 1.69, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,5-dimethyl-3,6-dihydro-2H-pyridin-4-yl)ethanimine is sourced from PubChem (CID 170634493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).