1-(3-pyrrolidin-1-ylpropyl)pyrazol-3-amine

C10H18N4 — CID 54594439

IUPAC1-(3-pyrrolidin-1-ylpropyl)pyrazol-3-amine
SMILESNc1ccn(CCCN2CCCC2)n1
InChIInChI=1S/C10H18N4/c11-10-4-9-14(12-10)8-3-7-13-5-1-2-6-13/h4,9H,1-3,5-8H2,(H2,11,12)
InChIKeyVLIIOALGIBENKI-UHFFFAOYSA-N
MW194.28 g/mol
LogP0.95
Rot. Bonds4

About 1-(3-pyrrolidin-1-ylpropyl)pyrazol-3-amine

1-(3-pyrrolidin-1-ylpropyl)pyrazol-3-amine (PubChem CID 54594439) has the molecular formula C10H18N4 and a molecular weight of 194.28 g/mol. Its IUPAC name is 1-(3-pyrrolidin-1-ylpropyl)pyrazol-3-amine.

Molecular Properties

Compound Name1-(3-pyrrolidin-1-ylpropyl)pyrazol-3-amine
PubChem CID54594439
Molecular FormulaC10H18N4
Molecular Weight194.28 g/mol
Exact Mass194.15
IUPAC Name1-(3-pyrrolidin-1-ylpropyl)pyrazol-3-amine
SMILESNc1ccn(CCCN2CCCC2)n1
InChIInChI=1S/C10H18N4/c11-10-4-9-14(12-10)8-3-7-13-5-1-2-6-13/h4,9H,1-3,5-8H2,(H2,11,12)
InChIKeyVLIIOALGIBENKI-UHFFFAOYSA-N
XLogP0.95
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(3-pyrrolidin-1-ylpropyl)pyrazol-3-amine?
The IUPAC name of 1-(3-pyrrolidin-1-ylpropyl)pyrazol-3-amine (CID 54594439) is 1-(3-pyrrolidin-1-ylpropyl)pyrazol-3-amine.
What is the SMILES notation for 1-(3-pyrrolidin-1-ylpropyl)pyrazol-3-amine?
The canonical SMILES for 1-(3-pyrrolidin-1-ylpropyl)pyrazol-3-amine is Nc1ccn(CCCN2CCCC2)n1.
What is the InChIKey of 1-(3-pyrrolidin-1-ylpropyl)pyrazol-3-amine?
The InChIKey is VLIIOALGIBENKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4/c11-10-4-9-14(12-10)8-3-7-13-5-1-2-6-13/h4,9H,1-3,5-8H2,(H2,11,12).
What are the key properties of 1-(3-pyrrolidin-1-ylpropyl)pyrazol-3-amine?
1-(3-pyrrolidin-1-ylpropyl)pyrazol-3-amine has a molecular weight of 194.28 g/mol, XLogP of 0.95, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-pyrrolidin-1-ylpropyl)pyrazol-3-amine is sourced from PubChem (CID 54594439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).