5-methoxy-3-propyl-1-pyrrolidin-3-ylpyrazole

C11H19N3O — CID 84722964

IUPAC5-methoxy-3-propyl-1-pyrrolidin-3-ylpyrazole
SMILESCCCc1cc(OC)n(C2CCNC2)n1
InChIInChI=1S/C11H19N3O/c1-3-4-9-7-11(15-2)14(13-9)10-5-6-12-8-10/h7,10,12H,3-6,8H2,1-2H3
InChIKeyITXNUIBOXYUWKI-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.38
Rot. Bonds4

About 5-methoxy-3-propyl-1-pyrrolidin-3-ylpyrazole

5-methoxy-3-propyl-1-pyrrolidin-3-ylpyrazole (PubChem CID 84722964) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 5-methoxy-3-propyl-1-pyrrolidin-3-ylpyrazole.

Molecular Properties

Compound Name5-methoxy-3-propyl-1-pyrrolidin-3-ylpyrazole
PubChem CID84722964
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name5-methoxy-3-propyl-1-pyrrolidin-3-ylpyrazole
SMILESCCCc1cc(OC)n(C2CCNC2)n1
InChIInChI=1S/C11H19N3O/c1-3-4-9-7-11(15-2)14(13-9)10-5-6-12-8-10/h7,10,12H,3-6,8H2,1-2H3
InChIKeyITXNUIBOXYUWKI-UHFFFAOYSA-N
XLogP1.38
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 69765146
5-(Difluoromethoxy)-3-pentyl-1-prop-2-enylpyrazole
CID 69778176
3-(1,1-Difluoroethyl)-5-methoxy-1-propan-2-ylpyrazole
CID 169945045
4,4,4-trifluoro-1-(5-methoxy-1-methylpyrazol-3-yl)-N-methylbutan-1-amine
CID 114255447
5,5,5-trifluoro-1-(5-methoxy-1-methylpyrazol-3-yl)-N-methylpentan-1-amine
CID 114255514
2-(3,3-Difluorocyclopentyl)-1-(5-methoxy-1-methylpyrazol-3-yl)ethanamine
CID 114255592
Ethyl (1-ethyl-3-propylpyrazol-5-yl) carbonate
CID 17775472
3-Methoxy-1-methyl-5-pyrrolidin-2-ylpyrazole
CID 82654621
1-(3-Methoxy-1-methyl-1h-pyrazol-5-yl)-n-methylethanamine
CID 89816521
2-Methoxy-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine
CID 118164873
2-methoxy-4H,5H,6H-pyrrolo[1,2-b]pyrazole
CID 118180756
3-Methoxy-1-methyl-5-(2-methylpropyl)pyrazole
CID 118345083

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-3-propyl-1-pyrrolidin-3-ylpyrazole?
The IUPAC name of 5-methoxy-3-propyl-1-pyrrolidin-3-ylpyrazole (CID 84722964) is 5-methoxy-3-propyl-1-pyrrolidin-3-ylpyrazole.
What is the SMILES notation for 5-methoxy-3-propyl-1-pyrrolidin-3-ylpyrazole?
The canonical SMILES for 5-methoxy-3-propyl-1-pyrrolidin-3-ylpyrazole is CCCc1cc(OC)n(C2CCNC2)n1.
What is the InChIKey of 5-methoxy-3-propyl-1-pyrrolidin-3-ylpyrazole?
The InChIKey is ITXNUIBOXYUWKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-3-4-9-7-11(15-2)14(13-9)10-5-6-12-8-10/h7,10,12H,3-6,8H2,1-2H3.
What are the key properties of 5-methoxy-3-propyl-1-pyrrolidin-3-ylpyrazole?
5-methoxy-3-propyl-1-pyrrolidin-3-ylpyrazole has a molecular weight of 209.29 g/mol, XLogP of 1.38, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-3-propyl-1-pyrrolidin-3-ylpyrazole is sourced from PubChem (CID 84722964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).