ethane;4-methyl-3-[(Z)-prop-1-enyl]-1,2-dihydropyridazine

C10H18N2 — CID 145387893

IUPACethane;4-methyl-3-[(Z)-prop-1-enyl]-1,2-dihydropyridazine
SMILESC/C=C\C1=C(C)C=CNN1.CC
InChIInChI=1S/C8H12N2.C2H6/c1-3-4-8-7(2)5-6-9-10-8;1-2/h3-6,9-10H,1-2H3;1-2H3/b4-3-;
InChIKeyMXLWYCGTRGPEAY-LNKPDPKZSA-N
MW166.27 g/mol
LogP2.48
Rot. Bonds1

About ethane;4-methyl-3-[(Z)-prop-1-enyl]-1,2-dihydropyridazine

ethane;4-methyl-3-[(Z)-prop-1-enyl]-1,2-dihydropyridazine (PubChem CID 145387893) has the molecular formula C10H18N2 and a molecular weight of 166.27 g/mol. Its IUPAC name is ethane;4-methyl-3-[(Z)-prop-1-enyl]-1,2-dihydropyridazine.

Molecular Properties

Compound Nameethane;4-methyl-3-[(Z)-prop-1-enyl]-1,2-dihydropyridazine
PubChem CID145387893
Molecular FormulaC10H18N2
Molecular Weight166.27 g/mol
Exact Mass166.15
IUPAC Nameethane;4-methyl-3-[(Z)-prop-1-enyl]-1,2-dihydropyridazine
SMILESC/C=C\C1=C(C)C=CNN1.CC
InChIInChI=1S/C8H12N2.C2H6/c1-3-4-8-7(2)5-6-9-10-8;1-2/h3-6,9-10H,1-2H3;1-2H3/b4-3-;
InChIKeyMXLWYCGTRGPEAY-LNKPDPKZSA-N
XLogP2.48
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.27
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethane;4-methyl-3-[(Z)-prop-1-enyl]-1,2-dihydropyridazine?
The IUPAC name of ethane;4-methyl-3-[(Z)-prop-1-enyl]-1,2-dihydropyridazine (CID 145387893) is ethane;4-methyl-3-[(Z)-prop-1-enyl]-1,2-dihydropyridazine.
What is the SMILES notation for ethane;4-methyl-3-[(Z)-prop-1-enyl]-1,2-dihydropyridazine?
The canonical SMILES for ethane;4-methyl-3-[(Z)-prop-1-enyl]-1,2-dihydropyridazine is C/C=C\C1=C(C)C=CNN1.CC.
What is the InChIKey of ethane;4-methyl-3-[(Z)-prop-1-enyl]-1,2-dihydropyridazine?
The InChIKey is MXLWYCGTRGPEAY-LNKPDPKZSA-N. The full InChI is InChI=1S/C8H12N2.C2H6/c1-3-4-8-7(2)5-6-9-10-8;1-2/h3-6,9-10H,1-2H3;1-2H3/b4-3-;.
What are the key properties of ethane;4-methyl-3-[(Z)-prop-1-enyl]-1,2-dihydropyridazine?
ethane;4-methyl-3-[(Z)-prop-1-enyl]-1,2-dihydropyridazine has a molecular weight of 166.27 g/mol, XLogP of 2.48, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-methyl-3-[(Z)-prop-1-enyl]-1,2-dihydropyridazine is sourced from PubChem (CID 145387893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).