ethane;(2E)-N-methyl-2-(1-methyl-3-methylidenepiperidin-2-ylidene)ethanimine

C12H22N2 — CID 143610086

IUPACethane;(2E)-N-methyl-2-(1-methyl-3-methylidenepiperidin-2-ylidene)ethanimine
SMILESC=C1CCCN(C)/C1=C/C=N/C.CC
InChIInChI=1S/C10H16N2.C2H6/c1-9-5-4-8-12(3)10(9)6-7-11-2;1-2/h6-7H,1,4-5,8H2,2-3H3;1-2H3/b10-6+,11-7+;
InChIKeyPAFZJFPMUFVQCS-MODGIHDZSA-N
MW194.32 g/mol
LogP2.88
Rot. Bonds1

About ethane;(2E)-N-methyl-2-(1-methyl-3-methylidenepiperidin-2-ylidene)ethanimine

ethane;(2E)-N-methyl-2-(1-methyl-3-methylidenepiperidin-2-ylidene)ethanimine (PubChem CID 143610086) has the molecular formula C12H22N2 and a molecular weight of 194.32 g/mol. Its IUPAC name is ethane;(2E)-N-methyl-2-(1-methyl-3-methylidenepiperidin-2-ylidene)ethanimine.

Molecular Properties

Compound Nameethane;(2E)-N-methyl-2-(1-methyl-3-methylidenepiperidin-2-ylidene)ethanimine
PubChem CID143610086
Molecular FormulaC12H22N2
Molecular Weight194.32 g/mol
Exact Mass194.18
IUPAC Nameethane;(2E)-N-methyl-2-(1-methyl-3-methylidenepiperidin-2-ylidene)ethanimine
SMILESC=C1CCCN(C)/C1=C/C=N/C.CC
InChIInChI=1S/C10H16N2.C2H6/c1-9-5-4-8-12(3)10(9)6-7-11-2;1-2/h6-7H,1,4-5,8H2,2-3H3;1-2H3/b10-6+,11-7+;
InChIKeyPAFZJFPMUFVQCS-MODGIHDZSA-N
XLogP2.88
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.32
LogP ≤ 52.88
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

2,2-Dimethyl-4-piperidino-2,3-dihydropyridin
CID 137530180
N-(1,2,2-trimethyl-1,2,3,4-tetrahydropyridin-4-ylidene)piperidin-1-ium iodide
CID 156630785
5-Methyl-7-(4-methylpiperazin-1-yl)-3,4-dihydroazocine
CID 123161122
5-(piperidin-1-ylmethyl)-4H-azepine
CID 123405058
(3Z)-N,1-dimethyl-3-prop-2-enylidenepiperidin-4-imine
CID 123418614
2-(2-Butan-2-ylidenepiperidin-3-ylidene)ethylidene-dimethylazanium
CID 123426179
2-Methyl-7-propan-2-yl-1,3,4,5-tetrahydropyrido[3,4-c]azepine
CID 124009778
1-methyl-4-[1-(3-propyl-2H-pyrrol-5-yl)ethenyl]piperazine
CID 129029428
1-prop-1-en-2-yl-4-(2H-pyrrol-3-yl)piperidine
CID 130217430
4-Methyl-7-piperidin-1-yl-2-azabicyclo[3.2.0]hepta-2,4,6-triene
CID 130224497
(2E)-1-methyl-2-(3-methylbut-2-enylidene)-3-methylidenepiperidine
CID 134253847
2,7-Dimethyl-4,6,8,9-tetrahydropyrido[4,3-b]azepine
CID 134406498

Frequently Asked Questions

What is the IUPAC name of ethane;(2E)-N-methyl-2-(1-methyl-3-methylidenepiperidin-2-ylidene)ethanimine?
The IUPAC name of ethane;(2E)-N-methyl-2-(1-methyl-3-methylidenepiperidin-2-ylidene)ethanimine (CID 143610086) is ethane;(2E)-N-methyl-2-(1-methyl-3-methylidenepiperidin-2-ylidene)ethanimine.
What is the SMILES notation for ethane;(2E)-N-methyl-2-(1-methyl-3-methylidenepiperidin-2-ylidene)ethanimine?
The canonical SMILES for ethane;(2E)-N-methyl-2-(1-methyl-3-methylidenepiperidin-2-ylidene)ethanimine is C=C1CCCN(C)/C1=C/C=N/C.CC.
What is the InChIKey of ethane;(2E)-N-methyl-2-(1-methyl-3-methylidenepiperidin-2-ylidene)ethanimine?
The InChIKey is PAFZJFPMUFVQCS-MODGIHDZSA-N. The full InChI is InChI=1S/C10H16N2.C2H6/c1-9-5-4-8-12(3)10(9)6-7-11-2;1-2/h6-7H,1,4-5,8H2,2-3H3;1-2H3/b10-6+,11-7+;.
What are the key properties of ethane;(2E)-N-methyl-2-(1-methyl-3-methylidenepiperidin-2-ylidene)ethanimine?
ethane;(2E)-N-methyl-2-(1-methyl-3-methylidenepiperidin-2-ylidene)ethanimine has a molecular weight of 194.32 g/mol, XLogP of 2.88, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;(2E)-N-methyl-2-(1-methyl-3-methylidenepiperidin-2-ylidene)ethanimine is sourced from PubChem (CID 143610086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).