ethane;(3Z)-N-ethyl-3-ethylidene-4-methylpyridin-2-imine

C12H20N2 — CID 143716390

IUPACethane;(3Z)-N-ethyl-3-ethylidene-4-methylpyridin-2-imine
SMILESC/C=C1/C(C)=CC=N/C1=N\CC.CC
InChIInChI=1S/C10H14N2.C2H6/c1-4-9-8(3)6-7-12-10(9)11-5-2;1-2/h4,6-7H,5H2,1-3H3;1-2H3/b9-4-,11-10-;
InChIKeyVOGACVZPGLRXLX-CSLZCVJBSA-N
MW192.31 g/mol
LogP3.41
Rot. Bonds1

About ethane;(3Z)-N-ethyl-3-ethylidene-4-methylpyridin-2-imine

ethane;(3Z)-N-ethyl-3-ethylidene-4-methylpyridin-2-imine (PubChem CID 143716390) has the molecular formula C12H20N2 and a molecular weight of 192.31 g/mol. Its IUPAC name is ethane;(3Z)-N-ethyl-3-ethylidene-4-methylpyridin-2-imine.

Molecular Properties

Compound Nameethane;(3Z)-N-ethyl-3-ethylidene-4-methylpyridin-2-imine
PubChem CID143716390
Molecular FormulaC12H20N2
Molecular Weight192.31 g/mol
Exact Mass192.16
IUPAC Nameethane;(3Z)-N-ethyl-3-ethylidene-4-methylpyridin-2-imine
SMILESC/C=C1/C(C)=CC=N/C1=N\CC.CC
InChIInChI=1S/C10H14N2.C2H6/c1-4-9-8(3)6-7-12-10(9)11-5-2;1-2/h4,6-7H,5H2,1-3H3;1-2H3/b9-4-,11-10-;
InChIKeyVOGACVZPGLRXLX-CSLZCVJBSA-N
XLogP3.41
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors1
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 ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2,3-Dihydro-1,8-naphthyridine
CID 53699458
(2E,4Z)-2-(3-fluorobut-1-en-2-yl)-N'-methyl-N-prop-2-enylidenehexa-2,4-dienimidamide
CID 144934445
Carbanide;7,8-dihydropyrido[2,3-b][1,8]naphthyridine;promethium
CID 59491923
(3Z)-3-ethylidene-N-methylpyridin-2-imine
CID 68010675
N',3-dimethyl-N-methylidene-2,3-dihydropyridine-5-carboximidamide
CID 68309209
(3Z)-3-ethylidene-N-[(Z)-3-methylbut-1-enyl]pyridin-2-imine
CID 70306674
(3Z)-3-[(Z)-pent-3-en-2-ylidene]pyridin-2-imine
CID 117616998
(3Z)-3-ethylidene-N,4,5,6-tetramethylpyridin-2-imine
CID 117655581
N-(3-methylbut-3-enyl)-3,4-dihydroazepin-2-imine
CID 123185222
5-but-2-enylidene-4-methyl-4H-pyrimidine
CID 123720032
N,4-dimethyl-3H-pyridin-6-imine
CID 123755468
N-(3-methylidene-2H-pyridin-2-yl)propan-1-imine
CID 123993782

Frequently Asked Questions

What is the IUPAC name of ethane;(3Z)-N-ethyl-3-ethylidene-4-methylpyridin-2-imine?
The IUPAC name of ethane;(3Z)-N-ethyl-3-ethylidene-4-methylpyridin-2-imine (CID 143716390) is ethane;(3Z)-N-ethyl-3-ethylidene-4-methylpyridin-2-imine.
What is the SMILES notation for ethane;(3Z)-N-ethyl-3-ethylidene-4-methylpyridin-2-imine?
The canonical SMILES for ethane;(3Z)-N-ethyl-3-ethylidene-4-methylpyridin-2-imine is C/C=C1/C(C)=CC=N/C1=N\CC.CC.
What is the InChIKey of ethane;(3Z)-N-ethyl-3-ethylidene-4-methylpyridin-2-imine?
The InChIKey is VOGACVZPGLRXLX-CSLZCVJBSA-N. The full InChI is InChI=1S/C10H14N2.C2H6/c1-4-9-8(3)6-7-12-10(9)11-5-2;1-2/h4,6-7H,5H2,1-3H3;1-2H3/b9-4-,11-10-;.
What are the key properties of ethane;(3Z)-N-ethyl-3-ethylidene-4-methylpyridin-2-imine?
ethane;(3Z)-N-ethyl-3-ethylidene-4-methylpyridin-2-imine has a molecular weight of 192.31 g/mol, XLogP of 3.41, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;(3Z)-N-ethyl-3-ethylidene-4-methylpyridin-2-imine is sourced from PubChem (CID 143716390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).