4-cyclopropyl-1-(pyrrolidin-2-ylmethyl)pyrazole

C11H17N3 — CID 84733041

IUPAC4-cyclopropyl-1-(pyrrolidin-2-ylmethyl)pyrazole
SMILESc1nn(CC2CCCN2)cc1C1CC1
InChIInChI=1S/C11H17N3/c1-2-11(12-5-1)8-14-7-10(6-13-14)9-3-4-9/h6-7,9,11-12H,1-5,8H2
InChIKeyHRBOGTCKSIUVMK-UHFFFAOYSA-N
MW191.28 g/mol
LogP1.51
Rot. Bonds3

About 4-cyclopropyl-1-(pyrrolidin-2-ylmethyl)pyrazole

4-cyclopropyl-1-(pyrrolidin-2-ylmethyl)pyrazole (PubChem CID 84733041) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is 4-cyclopropyl-1-(pyrrolidin-2-ylmethyl)pyrazole.

Molecular Properties

Compound Name4-cyclopropyl-1-(pyrrolidin-2-ylmethyl)pyrazole
PubChem CID84733041
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name4-cyclopropyl-1-(pyrrolidin-2-ylmethyl)pyrazole
SMILESc1nn(CC2CCCN2)cc1C1CC1
InChIInChI=1S/C11H17N3/c1-2-11(12-5-1)8-14-7-10(6-13-14)9-3-4-9/h6-7,9,11-12H,1-5,8H2
InChIKeyHRBOGTCKSIUVMK-UHFFFAOYSA-N
XLogP1.51
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[1-(cyclohexylmethyl)pyrazol-4-yl]piperidine
CID 122240833
1-(pyrrolidin-2-ylmethyl)pyrazole
CID 25220770
1,4-dimethylpyrazole;ethane;4-propan-2-yl-1-(pyrrolidin-2-ylmethyl)pyrazole
CID 171834779
methyl 1-(piperidin-2-ylmethyl)pyrazole-4-carboxylate
CID 84735437
4-(3-bromo-4-methylphenyl)-1-(pyrrolidin-2-ylmethyl)pyrazole
CID 84604183
2-[[4-(furan-2-yl)pyrazol-1-yl]methyl]piperidine
CID 121214008
1-(pyrrolidin-2-ylmethyl)-4-[2-(trifluoromethyl)phenoxy]pyrazole
CID 117125009
4-[1-(oxan-2-ylmethyl)pyrazol-4-yl]piperidine
CID 122240754
2-(pyrrolidin-2-ylmethyl)triazole;hydrochloride
CID 86262246
4-(1-propylpyrazol-4-yl)azepane
CID 83261378
1-[[(2R)-pyrrolidin-2-yl]methyl]triazole
CID 98042437
2-[[4-(3-methylphenoxy)pyrazol-1-yl]methyl]piperidine
CID 117125038

Frequently Asked Questions

What is the IUPAC name of 4-cyclopropyl-1-(pyrrolidin-2-ylmethyl)pyrazole?
The IUPAC name of 4-cyclopropyl-1-(pyrrolidin-2-ylmethyl)pyrazole (CID 84733041) is 4-cyclopropyl-1-(pyrrolidin-2-ylmethyl)pyrazole.
What is the SMILES notation for 4-cyclopropyl-1-(pyrrolidin-2-ylmethyl)pyrazole?
The canonical SMILES for 4-cyclopropyl-1-(pyrrolidin-2-ylmethyl)pyrazole is c1nn(CC2CCCN2)cc1C1CC1.
What is the InChIKey of 4-cyclopropyl-1-(pyrrolidin-2-ylmethyl)pyrazole?
The InChIKey is HRBOGTCKSIUVMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c1-2-11(12-5-1)8-14-7-10(6-13-14)9-3-4-9/h6-7,9,11-12H,1-5,8H2.
What are the key properties of 4-cyclopropyl-1-(pyrrolidin-2-ylmethyl)pyrazole?
4-cyclopropyl-1-(pyrrolidin-2-ylmethyl)pyrazole has a molecular weight of 191.28 g/mol, XLogP of 1.51, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropyl-1-(pyrrolidin-2-ylmethyl)pyrazole is sourced from PubChem (CID 84733041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).