4,5-bis(ethenyl)-N-methyl-3,6-dihydro-2H-pyridin-1-amine;ethane

C12H22N2 — CID 171627361

IUPAC4,5-bis(ethenyl)-N-methyl-3,6-dihydro-2H-pyridin-1-amine;ethane
SMILESC=CC1=C(C=C)CN(NC)CC1.CC
InChIInChI=1S/C10H16N2.C2H6/c1-4-9-6-7-12(11-3)8-10(9)5-2;1-2/h4-5,11H,1-2,6-8H2,3H3;1-2H3
InChIKeyVUILZXUDIKBAIE-UHFFFAOYSA-N
MW194.32 g/mol
LogP2.52
Rot. Bonds3

About 4,5-bis(ethenyl)-N-methyl-3,6-dihydro-2H-pyridin-1-amine;ethane

4,5-bis(ethenyl)-N-methyl-3,6-dihydro-2H-pyridin-1-amine;ethane (PubChem CID 171627361) has the molecular formula C12H22N2 and a molecular weight of 194.32 g/mol. Its IUPAC name is 4,5-bis(ethenyl)-N-methyl-3,6-dihydro-2H-pyridin-1-amine;ethane.

Molecular Properties

Compound Name4,5-bis(ethenyl)-N-methyl-3,6-dihydro-2H-pyridin-1-amine;ethane
PubChem CID171627361
Molecular FormulaC12H22N2
Molecular Weight194.32 g/mol
Exact Mass194.18
IUPAC Name4,5-bis(ethenyl)-N-methyl-3,6-dihydro-2H-pyridin-1-amine;ethane
SMILESC=CC1=C(C=C)CN(NC)CC1.CC
InChIInChI=1S/C10H16N2.C2H6/c1-4-9-6-7-12(11-3)8-10(9)5-2;1-2/h4-5,11H,1-2,6-8H2,3H3;1-2H3
InChIKeyVUILZXUDIKBAIE-UHFFFAOYSA-N
XLogP2.52
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.32
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-Propan-2-yl-2,3,6,7-tetrahydroindazole
CID 60067164
2-ethyl-1-methyl-1-[(4E,6E)-octa-4,6-dienyl]hydrazine
CID 87095586
(1Z,3Z)-7-[amino(butyl)amino]-5-methylidenehepta-1,3-dien-1-amine
CID 89336476
2-Ethyl-1-methyl-1-octa-4,6-dienylhydrazine
CID 91249448
1-(Cyclohexa-1,5-dien-1-ylmethyl)-1-methylhydrazine
CID 118548974
4-ethyl-N-methyl-3,6-dihydro-2H-pyridin-1-amine
CID 123255221
1,1-Bis(2-methylidenepent-3-enyl)-2-prop-2-enylhydrazine
CID 123543479
6-butan-2-yl-5-ethenyl-3-ethyl-2,4-dihydro-1H-triazine
CID 130255757
1-(6-ethenyl-4-methylidene-2,3-dihydro-1H-pyridin-5-yl)-1-propylhydrazine
CID 134292157
1-[(3Z)-4-ethylhexa-3,5-dien-2-yl]-1,2-dimethylhydrazine
CID 138702798
1-[(2Z)-3-ethylpenta-2,4-dienyl]-1,2-dimethylhydrazine
CID 138702942
2-butan-2-yl-1-methyl-1-[(Z,3Z)-3-propylidenehept-4-enyl]hydrazine
CID 139456249

Frequently Asked Questions

What is the IUPAC name of 4,5-bis(ethenyl)-N-methyl-3,6-dihydro-2H-pyridin-1-amine;ethane?
The IUPAC name of 4,5-bis(ethenyl)-N-methyl-3,6-dihydro-2H-pyridin-1-amine;ethane (CID 171627361) is 4,5-bis(ethenyl)-N-methyl-3,6-dihydro-2H-pyridin-1-amine;ethane.
What is the SMILES notation for 4,5-bis(ethenyl)-N-methyl-3,6-dihydro-2H-pyridin-1-amine;ethane?
The canonical SMILES for 4,5-bis(ethenyl)-N-methyl-3,6-dihydro-2H-pyridin-1-amine;ethane is C=CC1=C(C=C)CN(NC)CC1.CC.
What is the InChIKey of 4,5-bis(ethenyl)-N-methyl-3,6-dihydro-2H-pyridin-1-amine;ethane?
The InChIKey is VUILZXUDIKBAIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2.C2H6/c1-4-9-6-7-12(11-3)8-10(9)5-2;1-2/h4-5,11H,1-2,6-8H2,3H3;1-2H3.
What are the key properties of 4,5-bis(ethenyl)-N-methyl-3,6-dihydro-2H-pyridin-1-amine;ethane?
4,5-bis(ethenyl)-N-methyl-3,6-dihydro-2H-pyridin-1-amine;ethane has a molecular weight of 194.32 g/mol, XLogP of 2.52, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-bis(ethenyl)-N-methyl-3,6-dihydro-2H-pyridin-1-amine;ethane is sourced from PubChem (CID 171627361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).