1-methyl-5-(2-propylpyrrolidin-2-yl)pyrazole

C11H19N3 — CID 66467391

IUPAC1-methyl-5-(2-propylpyrrolidin-2-yl)pyrazole
SMILESCCCC1(c2ccnn2C)CCCN1
InChIInChI=1S/C11H19N3/c1-3-6-11(7-4-8-12-11)10-5-9-13-14(10)2/h5,9,12H,3-4,6-8H2,1-2H3
InChIKeySRBLFTWENZSWBT-UHFFFAOYSA-N
MW193.29 g/mol
LogP1.80
Rot. Bonds3

About 1-methyl-5-(2-propylpyrrolidin-2-yl)pyrazole

1-methyl-5-(2-propylpyrrolidin-2-yl)pyrazole (PubChem CID 66467391) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is 1-methyl-5-(2-propylpyrrolidin-2-yl)pyrazole.

Molecular Properties

Compound Name1-methyl-5-(2-propylpyrrolidin-2-yl)pyrazole
PubChem CID66467391
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name1-methyl-5-(2-propylpyrrolidin-2-yl)pyrazole
SMILESCCCC1(c2ccnn2C)CCCN1
InChIInChI=1S/C11H19N3/c1-3-6-11(7-4-8-12-11)10-5-9-13-14(10)2/h5,9,12H,3-4,6-8H2,1-2H3
InChIKeySRBLFTWENZSWBT-UHFFFAOYSA-N
XLogP1.80
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-5-(2-propylpyrrolidin-2-yl)pyrazole?
The IUPAC name of 1-methyl-5-(2-propylpyrrolidin-2-yl)pyrazole (CID 66467391) is 1-methyl-5-(2-propylpyrrolidin-2-yl)pyrazole.
What is the SMILES notation for 1-methyl-5-(2-propylpyrrolidin-2-yl)pyrazole?
The canonical SMILES for 1-methyl-5-(2-propylpyrrolidin-2-yl)pyrazole is CCCC1(c2ccnn2C)CCCN1.
What is the InChIKey of 1-methyl-5-(2-propylpyrrolidin-2-yl)pyrazole?
The InChIKey is SRBLFTWENZSWBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-3-6-11(7-4-8-12-11)10-5-9-13-14(10)2/h5,9,12H,3-4,6-8H2,1-2H3.
What are the key properties of 1-methyl-5-(2-propylpyrrolidin-2-yl)pyrazole?
1-methyl-5-(2-propylpyrrolidin-2-yl)pyrazole has a molecular weight of 193.29 g/mol, XLogP of 1.80, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-5-(2-propylpyrrolidin-2-yl)pyrazole is sourced from PubChem (CID 66467391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).