3-(cyclohexylmethyl)-6-methyl-1,2-dihydropyridazine

C12H20N2 — CID 143857596

IUPAC3-(cyclohexylmethyl)-6-methyl-1,2-dihydropyridazine
SMILESCC1=CC=C(CC2CCCCC2)NN1
InChIInChI=1S/C12H20N2/c1-10-7-8-12(14-13-10)9-11-5-3-2-4-6-11/h7-8,11,13-14H,2-6,9H2,1H3
InChIKeyYLGXCMQRRUSLSE-UHFFFAOYSA-N
MW192.31 g/mol
LogP2.85
Rot. Bonds2

About 3-(cyclohexylmethyl)-6-methyl-1,2-dihydropyridazine

3-(cyclohexylmethyl)-6-methyl-1,2-dihydropyridazine (PubChem CID 143857596) has the molecular formula C12H20N2 and a molecular weight of 192.31 g/mol. Its IUPAC name is 3-(cyclohexylmethyl)-6-methyl-1,2-dihydropyridazine.

Molecular Properties

Compound Name3-(cyclohexylmethyl)-6-methyl-1,2-dihydropyridazine
PubChem CID143857596
Molecular FormulaC12H20N2
Molecular Weight192.31 g/mol
Exact Mass192.16
IUPAC Name3-(cyclohexylmethyl)-6-methyl-1,2-dihydropyridazine
SMILESCC1=CC=C(CC2CCCCC2)NN1
InChIInChI=1S/C12H20N2/c1-10-7-8-12(14-13-10)9-11-5-3-2-4-6-11/h7-8,11,13-14H,2-6,9H2,1H3
InChIKeyYLGXCMQRRUSLSE-UHFFFAOYSA-N
XLogP2.85
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.31
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(cyclohexylmethyl)-6-methyl-1,2-dihydropyridazine?
The IUPAC name of 3-(cyclohexylmethyl)-6-methyl-1,2-dihydropyridazine (CID 143857596) is 3-(cyclohexylmethyl)-6-methyl-1,2-dihydropyridazine.
What is the SMILES notation for 3-(cyclohexylmethyl)-6-methyl-1,2-dihydropyridazine?
The canonical SMILES for 3-(cyclohexylmethyl)-6-methyl-1,2-dihydropyridazine is CC1=CC=C(CC2CCCCC2)NN1.
What is the InChIKey of 3-(cyclohexylmethyl)-6-methyl-1,2-dihydropyridazine?
The InChIKey is YLGXCMQRRUSLSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2/c1-10-7-8-12(14-13-10)9-11-5-3-2-4-6-11/h7-8,11,13-14H,2-6,9H2,1H3.
What are the key properties of 3-(cyclohexylmethyl)-6-methyl-1,2-dihydropyridazine?
3-(cyclohexylmethyl)-6-methyl-1,2-dihydropyridazine has a molecular weight of 192.31 g/mol, XLogP of 2.85, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclohexylmethyl)-6-methyl-1,2-dihydropyridazine is sourced from PubChem (CID 143857596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).