(Z)-N-methoxy-1-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)methanimine

C8H14N2O — CID 6435812

IUPAC(Z)-N-methoxy-1-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)methanimine
SMILESCO/N=C\C1=CCCN(C)C1
InChIInChI=1S/C8H14N2O/c1-10-5-3-4-8(7-10)6-9-11-2/h4,6H,3,5,7H2,1-2H3/b9-6-
InChIKeyYMMXHEYLRHNXAB-TWGQIWQCSA-N
MW154.21 g/mol
LogP0.88
Rot. Bonds2

About (Z)-N-methoxy-1-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)methanimine

(Z)-N-methoxy-1-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)methanimine (PubChem CID 6435812) has the molecular formula C8H14N2O and a molecular weight of 154.21 g/mol. Its IUPAC name is (Z)-N-methoxy-1-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)methanimine.

Molecular Properties

Compound Name(Z)-N-methoxy-1-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)methanimine
PubChem CID6435812
Molecular FormulaC8H14N2O
Molecular Weight154.21 g/mol
Exact Mass154.11
IUPAC Name(Z)-N-methoxy-1-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)methanimine
SMILESCO/N=C\C1=CCCN(C)C1
InChIInChI=1S/C8H14N2O/c1-10-5-3-4-8(7-10)6-9-11-2/h4,6H,3,5,7H2,1-2H3/b9-6-
InChIKeyYMMXHEYLRHNXAB-TWGQIWQCSA-N
XLogP0.88
TPSA24.83 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.21
LogP ≤ 50.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-N-methoxy-1-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)methanimine?
The IUPAC name of (Z)-N-methoxy-1-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)methanimine (CID 6435812) is (Z)-N-methoxy-1-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)methanimine.
What is the SMILES notation for (Z)-N-methoxy-1-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)methanimine?
The canonical SMILES for (Z)-N-methoxy-1-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)methanimine is CO/N=C\C1=CCCN(C)C1.
What is the InChIKey of (Z)-N-methoxy-1-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)methanimine?
The InChIKey is YMMXHEYLRHNXAB-TWGQIWQCSA-N. The full InChI is InChI=1S/C8H14N2O/c1-10-5-3-4-8(7-10)6-9-11-2/h4,6H,3,5,7H2,1-2H3/b9-6-.
What are the key properties of (Z)-N-methoxy-1-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)methanimine?
(Z)-N-methoxy-1-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)methanimine has a molecular weight of 154.21 g/mol, XLogP of 0.88, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-methoxy-1-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)methanimine is sourced from PubChem (CID 6435812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).