N-[(2Z)-2-(6-methyl-3,4-dihydro-2H-pyridin-5-ylidene)ethyl]methanimine

C9H14N2 — CID 123375084

IUPACN-[(2Z)-2-(6-methyl-3,4-dihydro-2H-pyridin-5-ylidene)ethyl]methanimine
SMILESC=NC/C=C1/CCCN=C1C
InChIInChI=1S/C9H14N2/c1-8-9(5-7-10-2)4-3-6-11-8/h5H,2-4,6-7H2,1H3/b9-5-
InChIKeyFBFCGYOYZKSLRW-UITAMQMPSA-N
MW150.22 g/mol
LogP1.87
Rot. Bonds2

About N-[(2Z)-2-(6-methyl-3,4-dihydro-2H-pyridin-5-ylidene)ethyl]methanimine

N-[(2Z)-2-(6-methyl-3,4-dihydro-2H-pyridin-5-ylidene)ethyl]methanimine (PubChem CID 123375084) has the molecular formula C9H14N2 and a molecular weight of 150.22 g/mol. Its IUPAC name is N-[(2Z)-2-(6-methyl-3,4-dihydro-2H-pyridin-5-ylidene)ethyl]methanimine.

Molecular Properties

Compound NameN-[(2Z)-2-(6-methyl-3,4-dihydro-2H-pyridin-5-ylidene)ethyl]methanimine
PubChem CID123375084
Molecular FormulaC9H14N2
Molecular Weight150.22 g/mol
Exact Mass150.12
IUPAC NameN-[(2Z)-2-(6-methyl-3,4-dihydro-2H-pyridin-5-ylidene)ethyl]methanimine
SMILESC=NC/C=C1/CCCN=C1C
InChIInChI=1S/C9H14N2/c1-8-9(5-7-10-2)4-3-6-11-8/h5H,2-4,6-7H2,1H3/b9-5-
InChIKeyFBFCGYOYZKSLRW-UITAMQMPSA-N
XLogP1.87
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 51.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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CID 56972723
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6-[(E)-but-2-en-2-yl]-2,3,4,5-tetrahydropyridine
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CID 11009116
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CID 20558379
2,3,4,7,8,9-Hexahydropyrido[2,3-g]quinoline
CID 21835857
3-Butyl-6-methyl-2,5-dihydropyridine
CID 57086307
2,3-Diethyl-2,5-dihydropyridine
CID 57226784
4-diazo-N-ethyl-2-methylcyclohex-2-en-1-imine
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CID 68383572

Frequently Asked Questions

What is the IUPAC name of N-[(2Z)-2-(6-methyl-3,4-dihydro-2H-pyridin-5-ylidene)ethyl]methanimine?
The IUPAC name of N-[(2Z)-2-(6-methyl-3,4-dihydro-2H-pyridin-5-ylidene)ethyl]methanimine (CID 123375084) is N-[(2Z)-2-(6-methyl-3,4-dihydro-2H-pyridin-5-ylidene)ethyl]methanimine.
What is the SMILES notation for N-[(2Z)-2-(6-methyl-3,4-dihydro-2H-pyridin-5-ylidene)ethyl]methanimine?
The canonical SMILES for N-[(2Z)-2-(6-methyl-3,4-dihydro-2H-pyridin-5-ylidene)ethyl]methanimine is C=NC/C=C1/CCCN=C1C.
What is the InChIKey of N-[(2Z)-2-(6-methyl-3,4-dihydro-2H-pyridin-5-ylidene)ethyl]methanimine?
The InChIKey is FBFCGYOYZKSLRW-UITAMQMPSA-N. The full InChI is InChI=1S/C9H14N2/c1-8-9(5-7-10-2)4-3-6-11-8/h5H,2-4,6-7H2,1H3/b9-5-.
What are the key properties of N-[(2Z)-2-(6-methyl-3,4-dihydro-2H-pyridin-5-ylidene)ethyl]methanimine?
N-[(2Z)-2-(6-methyl-3,4-dihydro-2H-pyridin-5-ylidene)ethyl]methanimine has a molecular weight of 150.22 g/mol, XLogP of 1.87, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2Z)-2-(6-methyl-3,4-dihydro-2H-pyridin-5-ylidene)ethyl]methanimine is sourced from PubChem (CID 123375084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).