ethane;1-ethenyl-N,3,5-trimethylpyridin-2-imine

C12H20N2 — CID 168895439

IUPACethane;1-ethenyl-N,3,5-trimethylpyridin-2-imine
SMILESC=Cn1cc(C)cc(C)/c1=N\C.CC
InChIInChI=1S/C10H14N2.C2H6/c1-5-12-7-8(2)6-9(3)10(12)11-4;1-2/h5-7H,1H2,2-4H3;1-2H3/b11-10+;
InChIKeyXELYOBWGYKYYEE-ASTDGNLGSA-N
MW192.31 g/mol
LogP2.76
Rot. Bonds1

About ethane;1-ethenyl-N,3,5-trimethylpyridin-2-imine

ethane;1-ethenyl-N,3,5-trimethylpyridin-2-imine (PubChem CID 168895439) has the molecular formula C12H20N2 and a molecular weight of 192.31 g/mol. Its IUPAC name is ethane;1-ethenyl-N,3,5-trimethylpyridin-2-imine.

Molecular Properties

Compound Nameethane;1-ethenyl-N,3,5-trimethylpyridin-2-imine
PubChem CID168895439
Molecular FormulaC12H20N2
Molecular Weight192.31 g/mol
Exact Mass192.16
IUPAC Nameethane;1-ethenyl-N,3,5-trimethylpyridin-2-imine
SMILESC=Cn1cc(C)cc(C)/c1=N\C.CC
InChIInChI=1S/C10H14N2.C2H6/c1-5-12-7-8(2)6-9(3)10(12)11-4;1-2/h5-7H,1H2,2-4H3;1-2H3/b11-10+;
InChIKeyXELYOBWGYKYYEE-ASTDGNLGSA-N
XLogP2.76
TPSA17.29 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 ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-ethenyl-N-methyl-5-(trifluoromethyl)pyridin-2-imine
CID 146477817
N,N-diethyl-4-methyl-3H-azepin-2-amine
CID 12218528
N,N-diethyl-6-methyl-3H-azepin-2-amine
CID 12218529
N,N-diethyl-5-methyl-3H-azepin-2-amine
CID 12218538
N,N-diethyl-3,5-dimethyl-3H-azepin-2-amine
CID 85790494
N,N,5-trimethyl-3H-azepin-2-amine
CID 166441901
N,1,4-trimethylpyridin-2-imine
CID 23387651
4,8-dimethyl-5-methylidene-2H-pyrido[2,3-d]pyrimidin-2-ide;yttrium
CID 58666523
4-tert-butyl-N,1-dimethylpyridin-2-imine
CID 59485522
2-Ethenylimino-3-ethylpyridin-1-amine
CID 67490594
azane;5-[(E)-but-1-enyl]-3-methyl-4H-pyrimidine
CID 67633893
(5Z,7Z)-2-cyclohexa-1,3-dien-1-yl-1-methyl-4-methylidene-1,3-diazocine
CID 68215789

Frequently Asked Questions

What is the IUPAC name of ethane;1-ethenyl-N,3,5-trimethylpyridin-2-imine?
The IUPAC name of ethane;1-ethenyl-N,3,5-trimethylpyridin-2-imine (CID 168895439) is ethane;1-ethenyl-N,3,5-trimethylpyridin-2-imine.
What is the SMILES notation for ethane;1-ethenyl-N,3,5-trimethylpyridin-2-imine?
The canonical SMILES for ethane;1-ethenyl-N,3,5-trimethylpyridin-2-imine is C=Cn1cc(C)cc(C)/c1=N\C.CC.
What is the InChIKey of ethane;1-ethenyl-N,3,5-trimethylpyridin-2-imine?
The InChIKey is XELYOBWGYKYYEE-ASTDGNLGSA-N. The full InChI is InChI=1S/C10H14N2.C2H6/c1-5-12-7-8(2)6-9(3)10(12)11-4;1-2/h5-7H,1H2,2-4H3;1-2H3/b11-10+;.
What are the key properties of ethane;1-ethenyl-N,3,5-trimethylpyridin-2-imine?
ethane;1-ethenyl-N,3,5-trimethylpyridin-2-imine has a molecular weight of 192.31 g/mol, XLogP of 2.76, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-ethenyl-N,3,5-trimethylpyridin-2-imine is sourced from PubChem (CID 168895439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).