(2E)-N,4-dimethyl-2-propylidenepyridin-3-imine;ethane

C12H20N2 — CID 142610959

IUPAC(2E)-N,4-dimethyl-2-propylidenepyridin-3-imine;ethane
SMILESCC.CC/C=C1/N=CC=C(C)/C1=N\C
InChIInChI=1S/C10H14N2.C2H6/c1-4-5-9-10(11-3)8(2)6-7-12-9;1-2/h5-7H,4H2,1-3H3;1-2H3/b9-5+,11-10+;
InChIKeyBUJOWVHVBROVOC-LKAFKOLUSA-N
MW192.31 g/mol
LogP3.41
Rot. Bonds1

About (2E)-N,4-dimethyl-2-propylidenepyridin-3-imine;ethane

(2E)-N,4-dimethyl-2-propylidenepyridin-3-imine;ethane (PubChem CID 142610959) has the molecular formula C12H20N2 and a molecular weight of 192.31 g/mol. Its IUPAC name is (2E)-N,4-dimethyl-2-propylidenepyridin-3-imine;ethane.

Molecular Properties

Compound Name(2E)-N,4-dimethyl-2-propylidenepyridin-3-imine;ethane
PubChem CID142610959
Molecular FormulaC12H20N2
Molecular Weight192.31 g/mol
Exact Mass192.16
IUPAC Name(2E)-N,4-dimethyl-2-propylidenepyridin-3-imine;ethane
SMILESCC.CC/C=C1/N=CC=C(C)/C1=N\C
InChIInChI=1S/C10H14N2.C2H6/c1-4-5-9-10(11-3)8(2)6-7-12-9;1-2/h5-7H,4H2,1-3H3;1-2H3/b9-5+,11-10+;
InChIKeyBUJOWVHVBROVOC-LKAFKOLUSA-N
XLogP3.41
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.31
LogP ≤ 53.41
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

6-Propan-2-yl-3,4-dihydropyridine
CID 14979258
N-(6-propylidenecyclohexa-1,3-dien-1-yl)propan-1-imine
CID 53831115
2-tert-butyl-5-methylidene-4H-pyridine
CID 58468592
(2E)-2-ethylidene-N-methylpyridin-3-imine
CID 68010674
(3Z)-3-ethylidene-N-methylpyridin-4-imine
CID 68179744
(4Z)-4-ethylidene-N-methylpyridin-3-imine
CID 68179746
2-methyl-5-methylidene-4H-pyridine
CID 69535426
(E)-N-[(Z)-1-(4-methyl-2,3-dihydropyridin-6-yl)prop-1-enyl]but-2-en-1-imine
CID 71158073
2-ethylidene-N-methylpyridin-3-imine
CID 77385875
6-Propyl-3,4-dihydropyridine
CID 89142722
2-Methyl-4,5-dimethylidenepyridine
CID 89278992
(3Z)-3-[1-(ethylideneamino)ethylidene]pyridin-4-imine
CID 89712822

Frequently Asked Questions

What is the IUPAC name of (2E)-N,4-dimethyl-2-propylidenepyridin-3-imine;ethane?
The IUPAC name of (2E)-N,4-dimethyl-2-propylidenepyridin-3-imine;ethane (CID 142610959) is (2E)-N,4-dimethyl-2-propylidenepyridin-3-imine;ethane.
What is the SMILES notation for (2E)-N,4-dimethyl-2-propylidenepyridin-3-imine;ethane?
The canonical SMILES for (2E)-N,4-dimethyl-2-propylidenepyridin-3-imine;ethane is CC.CC/C=C1/N=CC=C(C)/C1=N\C.
What is the InChIKey of (2E)-N,4-dimethyl-2-propylidenepyridin-3-imine;ethane?
The InChIKey is BUJOWVHVBROVOC-LKAFKOLUSA-N. The full InChI is InChI=1S/C10H14N2.C2H6/c1-4-5-9-10(11-3)8(2)6-7-12-9;1-2/h5-7H,4H2,1-3H3;1-2H3/b9-5+,11-10+;.
What are the key properties of (2E)-N,4-dimethyl-2-propylidenepyridin-3-imine;ethane?
(2E)-N,4-dimethyl-2-propylidenepyridin-3-imine;ethane has a molecular weight of 192.31 g/mol, XLogP of 3.41, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2E)-N,4-dimethyl-2-propylidenepyridin-3-imine;ethane is sourced from PubChem (CID 142610959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).