1-(1-prop-2-enylpyrrolidin-3-yl)pyrazole

C10H15N3 — CID 130778362

IUPAC1-(1-prop-2-enylpyrrolidin-3-yl)pyrazole
SMILESC=CCN1CCC(n2cccn2)C1
InChIInChI=1S/C10H15N3/c1-2-6-12-8-4-10(9-12)13-7-3-5-11-13/h2-3,5,7,10H,1,4,6,8-9H2
InChIKeyGVADASMSKUYLQL-UHFFFAOYSA-N
MW177.25 g/mol
LogP1.32
Rot. Bonds3

About 1-(1-prop-2-enylpyrrolidin-3-yl)pyrazole

1-(1-prop-2-enylpyrrolidin-3-yl)pyrazole (PubChem CID 130778362) has the molecular formula C10H15N3 and a molecular weight of 177.25 g/mol. Its IUPAC name is 1-(1-prop-2-enylpyrrolidin-3-yl)pyrazole.

Molecular Properties

Compound Name1-(1-prop-2-enylpyrrolidin-3-yl)pyrazole
PubChem CID130778362
Molecular FormulaC10H15N3
Molecular Weight177.25 g/mol
Exact Mass177.13
IUPAC Name1-(1-prop-2-enylpyrrolidin-3-yl)pyrazole
SMILESC=CCN1CCC(n2cccn2)C1
InChIInChI=1S/C10H15N3/c1-2-6-12-8-4-10(9-12)13-7-3-5-11-13/h2-3,5,7,10H,1,4,6,8-9H2
InChIKeyGVADASMSKUYLQL-UHFFFAOYSA-N
XLogP1.32
TPSA21.06 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 51.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

4-[2-(3-pyrazol-1-ylpyrrolidin-1-yl)ethyl]morpholine
CID 126946440
1-[1-(oxan-4-ylmethyl)pyrrolidin-3-yl]pyrazole
CID 126946622
2-methyl-5-[(3-pyrazol-1-ylpyrrolidin-1-yl)methyl]pyrimidine
CID 126946539
1-(1-prop-2-enylpyrrolidin-3-yl)piperidin-4-amine
CID 80553821
3-[(3-pyrazol-1-ylpyrrolidin-1-yl)methyl]-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepine
CID 126946565
1-methyl-6-[(3-pyrazol-1-ylpyrrolidin-1-yl)methyl]pyrazin-2-one
CID 126946527
4-(3-pyrazol-1-ylpiperidin-1-yl)butan-1-ol
CID 110931810
1-[(2-methylcyclopropyl)methyl]-3-pyrazol-1-ylpiperidine
CID 86806817
3-[(3-pyrazol-1-ylpyrrolidin-1-yl)methyl]-4,5,6,7-tetrahydro-1H-indazole
CID 126946602
2-methyl-3-[(3-pyrazol-1-ylpyrrolidin-1-yl)methyl]-5,6-dihydro-4H-cyclopenta[c]pyrazole
CID 126946702
1-[1-(oxan-4-ylmethyl)azetidin-3-yl]pyrazole
CID 126900374
ethane;1-propan-2-yl-4-pyrazol-1-ylpiperidine
CID 156829114

Frequently Asked Questions

What is the IUPAC name of 1-(1-prop-2-enylpyrrolidin-3-yl)pyrazole?
The IUPAC name of 1-(1-prop-2-enylpyrrolidin-3-yl)pyrazole (CID 130778362) is 1-(1-prop-2-enylpyrrolidin-3-yl)pyrazole.
What is the SMILES notation for 1-(1-prop-2-enylpyrrolidin-3-yl)pyrazole?
The canonical SMILES for 1-(1-prop-2-enylpyrrolidin-3-yl)pyrazole is C=CCN1CCC(n2cccn2)C1.
What is the InChIKey of 1-(1-prop-2-enylpyrrolidin-3-yl)pyrazole?
The InChIKey is GVADASMSKUYLQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3/c1-2-6-12-8-4-10(9-12)13-7-3-5-11-13/h2-3,5,7,10H,1,4,6,8-9H2.
What are the key properties of 1-(1-prop-2-enylpyrrolidin-3-yl)pyrazole?
1-(1-prop-2-enylpyrrolidin-3-yl)pyrazole has a molecular weight of 177.25 g/mol, XLogP of 1.32, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-prop-2-enylpyrrolidin-3-yl)pyrazole is sourced from PubChem (CID 130778362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).