6-methylidene-1-[(Z)-pent-1-enyl]-3-propan-2-ylpyridazine

C13H20N2 — CID 174246566

IUPAC6-methylidene-1-[(Z)-pent-1-enyl]-3-propan-2-ylpyridazine
SMILESC=C1C=CC(C(C)C)=NN1/C=C\CCC
InChIInChI=1S/C13H20N2/c1-5-6-7-10-15-12(4)8-9-13(14-15)11(2)3/h7-11H,4-6H2,1-3H3/b10-7-
InChIKeySGPKOIHAYIICQY-YFHOEESVSA-N
MW204.32 g/mol
LogP3.70
Rot. Bonds4

About 6-methylidene-1-[(Z)-pent-1-enyl]-3-propan-2-ylpyridazine

6-methylidene-1-[(Z)-pent-1-enyl]-3-propan-2-ylpyridazine (PubChem CID 174246566) has the molecular formula C13H20N2 and a molecular weight of 204.32 g/mol. Its IUPAC name is 6-methylidene-1-[(Z)-pent-1-enyl]-3-propan-2-ylpyridazine.

Molecular Properties

Compound Name6-methylidene-1-[(Z)-pent-1-enyl]-3-propan-2-ylpyridazine
PubChem CID174246566
Molecular FormulaC13H20N2
Molecular Weight204.32 g/mol
Exact Mass204.16
IUPAC Name6-methylidene-1-[(Z)-pent-1-enyl]-3-propan-2-ylpyridazine
SMILESC=C1C=CC(C(C)C)=NN1/C=C\CCC
InChIInChI=1S/C13H20N2/c1-5-6-7-10-15-12(4)8-9-13(14-15)11(2)3/h7-11H,4-6H2,1-3H3/b10-7-
InChIKeySGPKOIHAYIICQY-YFHOEESVSA-N
XLogP3.70
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.32
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-methylidene-1-[(Z)-pent-1-enyl]-3-propan-2-ylpyridazine?
The IUPAC name of 6-methylidene-1-[(Z)-pent-1-enyl]-3-propan-2-ylpyridazine (CID 174246566) is 6-methylidene-1-[(Z)-pent-1-enyl]-3-propan-2-ylpyridazine.
What is the SMILES notation for 6-methylidene-1-[(Z)-pent-1-enyl]-3-propan-2-ylpyridazine?
The canonical SMILES for 6-methylidene-1-[(Z)-pent-1-enyl]-3-propan-2-ylpyridazine is C=C1C=CC(C(C)C)=NN1/C=C\CCC.
What is the InChIKey of 6-methylidene-1-[(Z)-pent-1-enyl]-3-propan-2-ylpyridazine?
The InChIKey is SGPKOIHAYIICQY-YFHOEESVSA-N. The full InChI is InChI=1S/C13H20N2/c1-5-6-7-10-15-12(4)8-9-13(14-15)11(2)3/h7-11H,4-6H2,1-3H3/b10-7-.
What are the key properties of 6-methylidene-1-[(Z)-pent-1-enyl]-3-propan-2-ylpyridazine?
6-methylidene-1-[(Z)-pent-1-enyl]-3-propan-2-ylpyridazine has a molecular weight of 204.32 g/mol, XLogP of 3.70, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methylidene-1-[(Z)-pent-1-enyl]-3-propan-2-ylpyridazine is sourced from PubChem (CID 174246566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).