6,6-dimethyl-1-propan-2-ylpyridazine

C9H16N2 — CID 149468879

IUPAC6,6-dimethyl-1-propan-2-ylpyridazine
SMILESCC(C)N1N=CC=CC1(C)C
InChIInChI=1S/C9H16N2/c1-8(2)11-9(3,4)6-5-7-10-11/h5-8H,1-4H3
InChIKeyZAYTUSXGNFMHEN-UHFFFAOYSA-N
MW152.24 g/mol
LogP2.03
Rot. Bonds1

About 6,6-dimethyl-1-propan-2-ylpyridazine

6,6-dimethyl-1-propan-2-ylpyridazine (PubChem CID 149468879) has the molecular formula C9H16N2 and a molecular weight of 152.24 g/mol. Its IUPAC name is 6,6-dimethyl-1-propan-2-ylpyridazine.

Molecular Properties

Compound Name6,6-dimethyl-1-propan-2-ylpyridazine
PubChem CID149468879
Molecular FormulaC9H16N2
Molecular Weight152.24 g/mol
Exact Mass152.13
IUPAC Name6,6-dimethyl-1-propan-2-ylpyridazine
SMILESCC(C)N1N=CC=CC1(C)C
InChIInChI=1S/C9H16N2/c1-8(2)11-9(3,4)6-5-7-10-11/h5-8H,1-4H3
InChIKeyZAYTUSXGNFMHEN-UHFFFAOYSA-N
XLogP2.03
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 52.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6,6-dimethyl-1-propan-2-ylpyridazine?
The IUPAC name of 6,6-dimethyl-1-propan-2-ylpyridazine (CID 149468879) is 6,6-dimethyl-1-propan-2-ylpyridazine.
What is the SMILES notation for 6,6-dimethyl-1-propan-2-ylpyridazine?
The canonical SMILES for 6,6-dimethyl-1-propan-2-ylpyridazine is CC(C)N1N=CC=CC1(C)C.
What is the InChIKey of 6,6-dimethyl-1-propan-2-ylpyridazine?
The InChIKey is ZAYTUSXGNFMHEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2/c1-8(2)11-9(3,4)6-5-7-10-11/h5-8H,1-4H3.
What are the key properties of 6,6-dimethyl-1-propan-2-ylpyridazine?
6,6-dimethyl-1-propan-2-ylpyridazine has a molecular weight of 152.24 g/mol, XLogP of 2.03, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6,6-dimethyl-1-propan-2-ylpyridazine is sourced from PubChem (CID 149468879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).