[3-(1-ethylpyrrolidin-3-yl)-1H-pyrazol-5-yl]methanamine

C10H18N4 — CID 115092182

IUPAC[3-(1-ethylpyrrolidin-3-yl)-1H-pyrazol-5-yl]methanamine
SMILESCCN1CCC(c2cc(CN)[nH]n2)C1
InChIInChI=1S/C10H18N4/c1-2-14-4-3-8(7-14)10-5-9(6-11)12-13-10/h5,8H,2-4,6-7,11H2,1H3,(H,12,13)
InChIKeyLXMIYTZKZCBAPT-UHFFFAOYSA-N
MW194.28 g/mol
LogP0.68
Rot. Bonds3

About [3-(1-ethylpyrrolidin-3-yl)-1H-pyrazol-5-yl]methanamine

[3-(1-ethylpyrrolidin-3-yl)-1H-pyrazol-5-yl]methanamine (PubChem CID 115092182) has the molecular formula C10H18N4 and a molecular weight of 194.28 g/mol. Its IUPAC name is [3-(1-ethylpyrrolidin-3-yl)-1H-pyrazol-5-yl]methanamine.

Molecular Properties

Compound Name[3-(1-ethylpyrrolidin-3-yl)-1H-pyrazol-5-yl]methanamine
PubChem CID115092182
Molecular FormulaC10H18N4
Molecular Weight194.28 g/mol
Exact Mass194.15
IUPAC Name[3-(1-ethylpyrrolidin-3-yl)-1H-pyrazol-5-yl]methanamine
SMILESCCN1CCC(c2cc(CN)[nH]n2)C1
InChIInChI=1S/C10H18N4/c1-2-14-4-3-8(7-14)10-5-9(6-11)12-13-10/h5,8H,2-4,6-7,11H2,1H3,(H,12,13)
InChIKeyLXMIYTZKZCBAPT-UHFFFAOYSA-N
XLogP0.68
TPSA57.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 50.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [3-(1-ethylpyrrolidin-3-yl)-1H-pyrazol-5-yl]methanamine?
The IUPAC name of [3-(1-ethylpyrrolidin-3-yl)-1H-pyrazol-5-yl]methanamine (CID 115092182) is [3-(1-ethylpyrrolidin-3-yl)-1H-pyrazol-5-yl]methanamine.
What is the SMILES notation for [3-(1-ethylpyrrolidin-3-yl)-1H-pyrazol-5-yl]methanamine?
The canonical SMILES for [3-(1-ethylpyrrolidin-3-yl)-1H-pyrazol-5-yl]methanamine is CCN1CCC(c2cc(CN)[nH]n2)C1.
What is the InChIKey of [3-(1-ethylpyrrolidin-3-yl)-1H-pyrazol-5-yl]methanamine?
The InChIKey is LXMIYTZKZCBAPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4/c1-2-14-4-3-8(7-14)10-5-9(6-11)12-13-10/h5,8H,2-4,6-7,11H2,1H3,(H,12,13).
What are the key properties of [3-(1-ethylpyrrolidin-3-yl)-1H-pyrazol-5-yl]methanamine?
[3-(1-ethylpyrrolidin-3-yl)-1H-pyrazol-5-yl]methanamine has a molecular weight of 194.28 g/mol, XLogP of 0.68, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(1-ethylpyrrolidin-3-yl)-1H-pyrazol-5-yl]methanamine is sourced from PubChem (CID 115092182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).