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

C10H18N2 — CID 123687603

IUPAC2-(2,5-dimethyl-3,4-dihydro-2H-pyridin-1-yl)-N-methylethanimine
SMILESC/N=C/CN1C=C(C)CCC1C
InChIInChI=1S/C10H18N2/c1-9-4-5-10(2)12(8-9)7-6-11-3/h6,8,10H,4-5,7H2,1-3H3/b11-6+
InChIKeyJTCRJSGVSOFRPB-IZZDOVSWSA-N
MW166.27 g/mol
LogP2.08
Rot. Bonds2

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

2-(2,5-dimethyl-3,4-dihydro-2H-pyridin-1-yl)-N-methylethanimine (PubChem CID 123687603) has the molecular formula C10H18N2 and a molecular weight of 166.27 g/mol. Its IUPAC name is 2-(2,5-dimethyl-3,4-dihydro-2H-pyridin-1-yl)-N-methylethanimine.

Molecular Properties

Compound Name2-(2,5-dimethyl-3,4-dihydro-2H-pyridin-1-yl)-N-methylethanimine
PubChem CID123687603
Molecular FormulaC10H18N2
Molecular Weight166.27 g/mol
Exact Mass166.15
IUPAC Name2-(2,5-dimethyl-3,4-dihydro-2H-pyridin-1-yl)-N-methylethanimine
SMILESC/N=C/CN1C=C(C)CCC1C
InChIInChI=1S/C10H18N2/c1-9-4-5-10(2)12(8-9)7-6-11-3/h6,8,10H,4-5,7H2,1-3H3/b11-6+
InChIKeyJTCRJSGVSOFRPB-IZZDOVSWSA-N
XLogP2.08
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.27
LogP ≤ 52.08
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 2-(2,5-dimethyl-3,4-dihydro-2H-pyridin-1-yl)-N-methylethanimine?
The IUPAC name of 2-(2,5-dimethyl-3,4-dihydro-2H-pyridin-1-yl)-N-methylethanimine (CID 123687603) is 2-(2,5-dimethyl-3,4-dihydro-2H-pyridin-1-yl)-N-methylethanimine.
What is the SMILES notation for 2-(2,5-dimethyl-3,4-dihydro-2H-pyridin-1-yl)-N-methylethanimine?
The canonical SMILES for 2-(2,5-dimethyl-3,4-dihydro-2H-pyridin-1-yl)-N-methylethanimine is C/N=C/CN1C=C(C)CCC1C.
What is the InChIKey of 2-(2,5-dimethyl-3,4-dihydro-2H-pyridin-1-yl)-N-methylethanimine?
The InChIKey is JTCRJSGVSOFRPB-IZZDOVSWSA-N. The full InChI is InChI=1S/C10H18N2/c1-9-4-5-10(2)12(8-9)7-6-11-3/h6,8,10H,4-5,7H2,1-3H3/b11-6+.
What are the key properties of 2-(2,5-dimethyl-3,4-dihydro-2H-pyridin-1-yl)-N-methylethanimine?
2-(2,5-dimethyl-3,4-dihydro-2H-pyridin-1-yl)-N-methylethanimine has a molecular weight of 166.27 g/mol, XLogP of 2.08, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethyl-3,4-dihydro-2H-pyridin-1-yl)-N-methylethanimine is sourced from PubChem (CID 123687603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).