2,3-dimethyl-1,5-dihydropyrazole

C5H10N2 — CID 71411041

IUPAC2,3-dimethyl-1,5-dihydropyrazole
SMILESCC1=CCNN1C
InChIInChI=1S/C5H10N2/c1-5-3-4-6-7(5)2/h3,6H,4H2,1-2H3
InChIKeyBXKMTBRZTXIJNO-UHFFFAOYSA-N
MW98.15 g/mol
LogP0.34
Rot. Bonds

About 2,3-dimethyl-1,5-dihydropyrazole

2,3-dimethyl-1,5-dihydropyrazole (PubChem CID 71411041) has the molecular formula C5H10N2 and a molecular weight of 98.15 g/mol. Its IUPAC name is 2,3-dimethyl-1,5-dihydropyrazole.

Molecular Properties

Compound Name2,3-dimethyl-1,5-dihydropyrazole
PubChem CID71411041
Molecular FormulaC5H10N2
Molecular Weight98.15 g/mol
Exact Mass98.08
IUPAC Name2,3-dimethyl-1,5-dihydropyrazole
SMILESCC1=CCNN1C
InChIInChI=1S/C5H10N2/c1-5-3-4-6-7(5)2/h3,6H,4H2,1-2H3
InChIKeyBXKMTBRZTXIJNO-UHFFFAOYSA-N
XLogP0.34
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50098.15
LogP ≤ 50.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-1,5-dihydropyrazole?
The IUPAC name of 2,3-dimethyl-1,5-dihydropyrazole (CID 71411041) is 2,3-dimethyl-1,5-dihydropyrazole.
What is the SMILES notation for 2,3-dimethyl-1,5-dihydropyrazole?
The canonical SMILES for 2,3-dimethyl-1,5-dihydropyrazole is CC1=CCNN1C.
What is the InChIKey of 2,3-dimethyl-1,5-dihydropyrazole?
The InChIKey is BXKMTBRZTXIJNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2/c1-5-3-4-6-7(5)2/h3,6H,4H2,1-2H3.
What are the key properties of 2,3-dimethyl-1,5-dihydropyrazole?
2,3-dimethyl-1,5-dihydropyrazole has a molecular weight of 98.15 g/mol, XLogP of 0.34, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-1,5-dihydropyrazole is sourced from PubChem (CID 71411041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).