3-methyl-2,4-dihydrocyclopenta[c]pyrazole

C7H8N2 — CID 59741286

IUPAC3-methyl-2,4-dihydrocyclopenta[c]pyrazole
SMILESCc1[nH]nc2c1CC=C2
InChIInChI=1S/C7H8N2/c1-5-6-3-2-4-7(6)9-8-5/h2,4H,3H2,1H3,(H,8,9)
InChIKeyQDWRYBXFUDXTTD-UHFFFAOYSA-N
MW120.15 g/mol
LogP1.29
Rot. Bonds

About 3-methyl-2,4-dihydrocyclopenta[c]pyrazole

3-methyl-2,4-dihydrocyclopenta[c]pyrazole (PubChem CID 59741286) has the molecular formula C7H8N2 and a molecular weight of 120.15 g/mol. Its IUPAC name is 3-methyl-2,4-dihydrocyclopenta[c]pyrazole.

Molecular Properties

Compound Name3-methyl-2,4-dihydrocyclopenta[c]pyrazole
PubChem CID59741286
Molecular FormulaC7H8N2
Molecular Weight120.15 g/mol
Exact Mass120.07
IUPAC Name3-methyl-2,4-dihydrocyclopenta[c]pyrazole
SMILESCc1[nH]nc2c1CC=C2
InChIInChI=1S/C7H8N2/c1-5-6-3-2-4-7(6)9-8-5/h2,4H,3H2,1H3,(H,8,9)
InChIKeyQDWRYBXFUDXTTD-UHFFFAOYSA-N
XLogP1.29
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500120.15
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-2,4-dihydrocyclopenta[c]pyrazole?
The IUPAC name of 3-methyl-2,4-dihydrocyclopenta[c]pyrazole (CID 59741286) is 3-methyl-2,4-dihydrocyclopenta[c]pyrazole.
What is the SMILES notation for 3-methyl-2,4-dihydrocyclopenta[c]pyrazole?
The canonical SMILES for 3-methyl-2,4-dihydrocyclopenta[c]pyrazole is Cc1[nH]nc2c1CC=C2.
What is the InChIKey of 3-methyl-2,4-dihydrocyclopenta[c]pyrazole?
The InChIKey is QDWRYBXFUDXTTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2/c1-5-6-3-2-4-7(6)9-8-5/h2,4H,3H2,1H3,(H,8,9).
What are the key properties of 3-methyl-2,4-dihydrocyclopenta[c]pyrazole?
3-methyl-2,4-dihydrocyclopenta[c]pyrazole has a molecular weight of 120.15 g/mol, XLogP of 1.29, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2,4-dihydrocyclopenta[c]pyrazole is sourced from PubChem (CID 59741286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).