1-[2-(2-methylpyrrolidin-1-yl)ethyl]pyrazol-3-amine

C10H18N4 — CID 63318333

IUPAC1-[2-(2-methylpyrrolidin-1-yl)ethyl]pyrazol-3-amine
SMILESCC1CCCN1CCn1ccc(N)n1
InChIInChI=1S/C10H18N4/c1-9-3-2-5-13(9)7-8-14-6-4-10(11)12-14/h4,6,9H,2-3,5,7-8H2,1H3,(H2,11,12)
InChIKeyVHKIDZFPTJPGHN-UHFFFAOYSA-N
MW194.28 g/mol
LogP0.95
Rot. Bonds3

About 1-[2-(2-methylpyrrolidin-1-yl)ethyl]pyrazol-3-amine

1-[2-(2-methylpyrrolidin-1-yl)ethyl]pyrazol-3-amine (PubChem CID 63318333) has the molecular formula C10H18N4 and a molecular weight of 194.28 g/mol. Its IUPAC name is 1-[2-(2-methylpyrrolidin-1-yl)ethyl]pyrazol-3-amine.

Molecular Properties

Compound Name1-[2-(2-methylpyrrolidin-1-yl)ethyl]pyrazol-3-amine
PubChem CID63318333
Molecular FormulaC10H18N4
Molecular Weight194.28 g/mol
Exact Mass194.15
IUPAC Name1-[2-(2-methylpyrrolidin-1-yl)ethyl]pyrazol-3-amine
SMILESCC1CCCN1CCn1ccc(N)n1
InChIInChI=1S/C10H18N4/c1-9-3-2-5-13(9)7-8-14-6-4-10(11)12-14/h4,6,9H,2-3,5,7-8H2,1H3,(H2,11,12)
InChIKeyVHKIDZFPTJPGHN-UHFFFAOYSA-N
XLogP0.95
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
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-[2-(2-methylpyrrolidin-1-yl)ethyl]pyrazol-3-amine?
The IUPAC name of 1-[2-(2-methylpyrrolidin-1-yl)ethyl]pyrazol-3-amine (CID 63318333) is 1-[2-(2-methylpyrrolidin-1-yl)ethyl]pyrazol-3-amine.
What is the SMILES notation for 1-[2-(2-methylpyrrolidin-1-yl)ethyl]pyrazol-3-amine?
The canonical SMILES for 1-[2-(2-methylpyrrolidin-1-yl)ethyl]pyrazol-3-amine is CC1CCCN1CCn1ccc(N)n1.
What is the InChIKey of 1-[2-(2-methylpyrrolidin-1-yl)ethyl]pyrazol-3-amine?
The InChIKey is VHKIDZFPTJPGHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4/c1-9-3-2-5-13(9)7-8-14-6-4-10(11)12-14/h4,6,9H,2-3,5,7-8H2,1H3,(H2,11,12).
What are the key properties of 1-[2-(2-methylpyrrolidin-1-yl)ethyl]pyrazol-3-amine?
1-[2-(2-methylpyrrolidin-1-yl)ethyl]pyrazol-3-amine has a molecular weight of 194.28 g/mol, XLogP of 0.95, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-methylpyrrolidin-1-yl)ethyl]pyrazol-3-amine is sourced from PubChem (CID 63318333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).