5,5-dimethyl-1,4-dihydropyrazole

C5H10N2 — CID 557772

IUPAC5,5-dimethyl-1,4-dihydropyrazole
SMILESCC1(C)CC=NN1
InChIInChI=1S/C5H10N2/c1-5(2)3-4-6-7-5/h4,7H,3H2,1-2H3
InChIKeyFLYZAKYDSFYRRD-UHFFFAOYSA-N
MW98.15 g/mol
LogP0.74
Rot. Bonds

About 5,5-dimethyl-1,4-dihydropyrazole

5,5-dimethyl-1,4-dihydropyrazole (PubChem CID 557772) has the molecular formula C5H10N2 and a molecular weight of 98.15 g/mol. Its IUPAC name is 5,5-dimethyl-1,4-dihydropyrazole.

Molecular Properties

Compound Name5,5-dimethyl-1,4-dihydropyrazole
PubChem CID557772
Molecular FormulaC5H10N2
Molecular Weight98.15 g/mol
Exact Mass98.08
IUPAC Name5,5-dimethyl-1,4-dihydropyrazole
SMILESCC1(C)CC=NN1
InChIInChI=1S/C5H10N2/c1-5(2)3-4-6-7-5/h4,7H,3H2,1-2H3
InChIKeyFLYZAKYDSFYRRD-UHFFFAOYSA-N
XLogP0.74
TPSA24.39 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 ≤ 50.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-methyl-4,5-dihydro-1H-pyrazole
CID 549780
5-(propan-2-yl)-4,5-dihydro-1H-pyrazole
CID 58473803
3-Methyl-3-(trifluoromethyl)-2,4-dihydro-pyrazole
CID 24972981
Pyrazole, 4,5-dihydro-4-methyl-
CID 12334529
1H-Pyrazole, 4,5-dihydro-4,5-dimethyl-
CID 558148
N-[(E)-ethylideneamino]-2-methylpropan-2-amine
CID 11073380
N-[(E)-butylideneamino]-2-methylpropan-2-amine
CID 13183552
2-methyl-N-[(E)-2-methylpropylideneamino]propan-2-amine
CID 13183553
5-Ethyl-4-methyl-4,5-dihydro-1h-pyrazole
CID 12334532
2-methyl-N-[(E)-propylideneamino]propan-2-amine
CID 13183551
2-methyl-N-[(E)-pentylideneamino]propan-2-amine
CID 13301930
Spiro(2-pyrazoline-5,1'-cyclopropane)
CID 129815925

Frequently Asked Questions

What is the IUPAC name of 5,5-dimethyl-1,4-dihydropyrazole?
The IUPAC name of 5,5-dimethyl-1,4-dihydropyrazole (CID 557772) is 5,5-dimethyl-1,4-dihydropyrazole.
What is the SMILES notation for 5,5-dimethyl-1,4-dihydropyrazole?
The canonical SMILES for 5,5-dimethyl-1,4-dihydropyrazole is CC1(C)CC=NN1.
What is the InChIKey of 5,5-dimethyl-1,4-dihydropyrazole?
The InChIKey is FLYZAKYDSFYRRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2/c1-5(2)3-4-6-7-5/h4,7H,3H2,1-2H3.
What are the key properties of 5,5-dimethyl-1,4-dihydropyrazole?
5,5-dimethyl-1,4-dihydropyrazole has a molecular weight of 98.15 g/mol, XLogP of 0.74, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-dimethyl-1,4-dihydropyrazole is sourced from PubChem (CID 557772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).