5-propan-2-yl-1,6-dihydropyridazine

C7H12N2 — CID 137457702

IUPAC5-propan-2-yl-1,6-dihydropyridazine
SMILESCC(C)C1=CC=NNC1
InChIInChI=1S/C7H12N2/c1-6(2)7-3-4-8-9-5-7/h3-4,6,9H,5H2,1-2H3
InChIKeyMKJYXHPRPOIRDL-UHFFFAOYSA-N
MW124.19 g/mol
LogP1.16
Rot. Bonds1

About 5-propan-2-yl-1,6-dihydropyridazine

5-propan-2-yl-1,6-dihydropyridazine (PubChem CID 137457702) has the molecular formula C7H12N2 and a molecular weight of 124.19 g/mol. Its IUPAC name is 5-propan-2-yl-1,6-dihydropyridazine.

Molecular Properties

Compound Name5-propan-2-yl-1,6-dihydropyridazine
PubChem CID137457702
Molecular FormulaC7H12N2
Molecular Weight124.19 g/mol
Exact Mass124.10
IUPAC Name5-propan-2-yl-1,6-dihydropyridazine
SMILESCC(C)C1=CC=NNC1
InChIInChI=1S/C7H12N2/c1-6(2)7-3-4-8-9-5-7/h3-4,6,9H,5H2,1-2H3
InChIKeyMKJYXHPRPOIRDL-UHFFFAOYSA-N
XLogP1.16
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.19
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-Methyl-1,6-dihydropyridazine
CID 19962939
5,6-Dimethyl-1,6-dihydropyridazine
CID 20540597
3,5-Dimethyl-1,6-dihydropyridazine
CID 29927534
4-Propan-2-yl-1,6-dihydropyridazine
CID 132093041
N-[(Z)-[(Z)-3-methylpent-2-enylidene]amino]methanamine
CID 134445338
4-Propan-2-yl-1,6-dihydropyridazin-6-amine
CID 144665614
N-[(Z)-4-methylpent-2-enylideneamino]methanamine
CID 146392701
5-(2-Methylpropyl)-1,6-dihydropyridazine
CID 147888955
4-Ethyl-1,6-dihydropyridazine
CID 149294197
5-Ethyl-1,6-dihydropyridazine
CID 154021492
(E)-4-imino-2-propan-2-ylbut-2-en-1-amine
CID 156098190
6-Propan-2-yl-1,6-dihydropyridazine
CID 156225963

Frequently Asked Questions

What is the IUPAC name of 5-propan-2-yl-1,6-dihydropyridazine?
The IUPAC name of 5-propan-2-yl-1,6-dihydropyridazine (CID 137457702) is 5-propan-2-yl-1,6-dihydropyridazine.
What is the SMILES notation for 5-propan-2-yl-1,6-dihydropyridazine?
The canonical SMILES for 5-propan-2-yl-1,6-dihydropyridazine is CC(C)C1=CC=NNC1.
What is the InChIKey of 5-propan-2-yl-1,6-dihydropyridazine?
The InChIKey is MKJYXHPRPOIRDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2/c1-6(2)7-3-4-8-9-5-7/h3-4,6,9H,5H2,1-2H3.
What are the key properties of 5-propan-2-yl-1,6-dihydropyridazine?
5-propan-2-yl-1,6-dihydropyridazine has a molecular weight of 124.19 g/mol, XLogP of 1.16, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-propan-2-yl-1,6-dihydropyridazine is sourced from PubChem (CID 137457702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).