ethene;(6Z)-6-ethylidene-1-methyl-5-propan-2-ylpyridazine

C12H20N2 — CID 172576079

IUPACethene;(6Z)-6-ethylidene-1-methyl-5-propan-2-ylpyridazine
SMILESC/C=C1/C(C(C)C)=CC=NN1C.C=C
InChIInChI=1S/C10H16N2.C2H4/c1-5-10-9(8(2)3)6-7-11-12(10)4;1-2/h5-8H,1-4H3;1-2H2/b10-5-;
InChIKeyLMSYXWLHBREFKL-WIMVAJRLSA-N
MW192.31 g/mol
LogP3.21
Rot. Bonds1

About ethene;(6Z)-6-ethylidene-1-methyl-5-propan-2-ylpyridazine

ethene;(6Z)-6-ethylidene-1-methyl-5-propan-2-ylpyridazine (PubChem CID 172576079) has the molecular formula C12H20N2 and a molecular weight of 192.31 g/mol. Its IUPAC name is ethene;(6Z)-6-ethylidene-1-methyl-5-propan-2-ylpyridazine.

Molecular Properties

Compound Nameethene;(6Z)-6-ethylidene-1-methyl-5-propan-2-ylpyridazine
PubChem CID172576079
Molecular FormulaC12H20N2
Molecular Weight192.31 g/mol
Exact Mass192.16
IUPAC Nameethene;(6Z)-6-ethylidene-1-methyl-5-propan-2-ylpyridazine
SMILESC/C=C1/C(C(C)C)=CC=NN1C.C=C
InChIInChI=1S/C10H16N2.C2H4/c1-5-10-9(8(2)3)6-7-11-12(10)4;1-2/h5-8H,1-4H3;1-2H2/b10-5-;
InChIKeyLMSYXWLHBREFKL-WIMVAJRLSA-N
XLogP3.21
TPSA15.60 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 ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

5-Methyl-6-methylidenepyrido[1,2-b]pyridazine
CID 59284052
7-Methyl-6-methylidenepyrido[1,2-b]pyridazine
CID 59284144
1-methyl-N-(2-methylpropyl)-N-propyl-3a,7a-dihydroindazol-5-amine
CID 59514039
1,6-Dimethyl-5,6-dihydroindazole
CID 68021264
(6S)-1,6-dimethyl-5,6-dihydroindazole
CID 89510252
Ethane;5-methyl-6-methylidenepyrido[1,2-b]pyridazine
CID 91443773
2-hepta-3,5-dien-3-yl-3H-pyridazine
CID 91480402
3-Methyl-3,4-dihydropyrido[1,2-b]diazepine
CID 117711234
3,6-Dimethyl-3,4-dihydropyrido[1,2-b]diazepine
CID 123184632
2-Bromo-4,7-dimethyl-6,7-dihydropyridazino[1,6-a]azepine
CID 123488140
1-(5-Methylhept-3-en-3-yl)-6-methylidenepyridazine
CID 123569581
1-(5-Methylhept-3-en-1-yn-3-yl)-6-methylidenepyridazine
CID 123896861

Frequently Asked Questions

What is the IUPAC name of ethene;(6Z)-6-ethylidene-1-methyl-5-propan-2-ylpyridazine?
The IUPAC name of ethene;(6Z)-6-ethylidene-1-methyl-5-propan-2-ylpyridazine (CID 172576079) is ethene;(6Z)-6-ethylidene-1-methyl-5-propan-2-ylpyridazine.
What is the SMILES notation for ethene;(6Z)-6-ethylidene-1-methyl-5-propan-2-ylpyridazine?
The canonical SMILES for ethene;(6Z)-6-ethylidene-1-methyl-5-propan-2-ylpyridazine is C/C=C1/C(C(C)C)=CC=NN1C.C=C.
What is the InChIKey of ethene;(6Z)-6-ethylidene-1-methyl-5-propan-2-ylpyridazine?
The InChIKey is LMSYXWLHBREFKL-WIMVAJRLSA-N. The full InChI is InChI=1S/C10H16N2.C2H4/c1-5-10-9(8(2)3)6-7-11-12(10)4;1-2/h5-8H,1-4H3;1-2H2/b10-5-;.
What are the key properties of ethene;(6Z)-6-ethylidene-1-methyl-5-propan-2-ylpyridazine?
ethene;(6Z)-6-ethylidene-1-methyl-5-propan-2-ylpyridazine has a molecular weight of 192.31 g/mol, XLogP of 3.21, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethene;(6Z)-6-ethylidene-1-methyl-5-propan-2-ylpyridazine is sourced from PubChem (CID 172576079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).