4-methyl-2,3-dihydro-1H-pyrazole

C4H8N2 — CID 15046736

IUPAC4-methyl-2,3-dihydro-1H-pyrazole
SMILESCC1=CNNC1
InChIInChI=1S/C4H8N2/c1-4-2-5-6-3-4/h2,5-6H,3H2,1H3
InChIKeyCNJQNAOCUYWMQQ-UHFFFAOYSA-N
MW84.12 g/mol
LogP-0.00
Rot. Bonds

About 4-methyl-2,3-dihydro-1H-pyrazole

4-methyl-2,3-dihydro-1H-pyrazole (PubChem CID 15046736) has the molecular formula C4H8N2 and a molecular weight of 84.12 g/mol. Its IUPAC name is 4-methyl-2,3-dihydro-1H-pyrazole.

Molecular Properties

Compound Name4-methyl-2,3-dihydro-1H-pyrazole
PubChem CID15046736
Molecular FormulaC4H8N2
Molecular Weight84.12 g/mol
Exact Mass84.07
IUPAC Name4-methyl-2,3-dihydro-1H-pyrazole
SMILESCC1=CNNC1
InChIInChI=1S/C4H8N2/c1-4-2-5-6-3-4/h2,5-6H,3H2,1H3
InChIKeyCNJQNAOCUYWMQQ-UHFFFAOYSA-N
XLogP-0.00
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50084.12
LogP ≤ 5-0.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-2,3-dihydro-1H-pyrazole?
The IUPAC name of 4-methyl-2,3-dihydro-1H-pyrazole (CID 15046736) is 4-methyl-2,3-dihydro-1H-pyrazole.
What is the SMILES notation for 4-methyl-2,3-dihydro-1H-pyrazole?
The canonical SMILES for 4-methyl-2,3-dihydro-1H-pyrazole is CC1=CNNC1.
What is the InChIKey of 4-methyl-2,3-dihydro-1H-pyrazole?
The InChIKey is CNJQNAOCUYWMQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8N2/c1-4-2-5-6-3-4/h2,5-6H,3H2,1H3.
What are the key properties of 4-methyl-2,3-dihydro-1H-pyrazole?
4-methyl-2,3-dihydro-1H-pyrazole has a molecular weight of 84.12 g/mol, XLogP of -0.00, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2,3-dihydro-1H-pyrazole is sourced from PubChem (CID 15046736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).