1-[2-(4-aminopyrazol-1-yl)acetyl]-N-cyclopropylpyrrolidine-2-carboxamide

C13H19N5O2 — CID 61104989

IUPAC1-[2-(4-aminopyrazol-1-yl)acetyl]-N-cyclopropylpyrrolidine-2-carboxamide
SMILESNc1cnn(CC(=O)N2CCCC2C(=O)NC2CC2)c1
InChIInChI=1S/C13H19N5O2/c14-9-6-15-17(7-9)8-12(19)18-5-1-2-11(18)13(20)16-10-3-4-10/h6-7,10-11H,1-5,8,14H2,(H,16,20)
InChIKeyFTJUCLUPAMGWBB-UHFFFAOYSA-N
MW277.33 g/mol
LogP-0.27
Rot. Bonds4

About 1-[2-(4-aminopyrazol-1-yl)acetyl]-N-cyclopropylpyrrolidine-2-carboxamide

1-[2-(4-aminopyrazol-1-yl)acetyl]-N-cyclopropylpyrrolidine-2-carboxamide (PubChem CID 61104989) has the molecular formula C13H19N5O2 and a molecular weight of 277.33 g/mol. Its IUPAC name is 1-[2-(4-aminopyrazol-1-yl)acetyl]-N-cyclopropylpyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-[2-(4-aminopyrazol-1-yl)acetyl]-N-cyclopropylpyrrolidine-2-carboxamide
PubChem CID61104989
Molecular FormulaC13H19N5O2
Molecular Weight277.33 g/mol
Exact Mass277.15
IUPAC Name1-[2-(4-aminopyrazol-1-yl)acetyl]-N-cyclopropylpyrrolidine-2-carboxamide
SMILESNc1cnn(CC(=O)N2CCCC2C(=O)NC2CC2)c1
InChIInChI=1S/C13H19N5O2/c14-9-6-15-17(7-9)8-12(19)18-5-1-2-11(18)13(20)16-10-3-4-10/h6-7,10-11H,1-5,8,14H2,(H,16,20)
InChIKeyFTJUCLUPAMGWBB-UHFFFAOYSA-N
XLogP-0.27
TPSA93.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.33
LogP ≤ 5-0.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-aminopyrazol-1-yl)acetyl]-N-cyclopropylpyrrolidine-2-carboxamide?
The IUPAC name of 1-[2-(4-aminopyrazol-1-yl)acetyl]-N-cyclopropylpyrrolidine-2-carboxamide (CID 61104989) is 1-[2-(4-aminopyrazol-1-yl)acetyl]-N-cyclopropylpyrrolidine-2-carboxamide.
What is the SMILES notation for 1-[2-(4-aminopyrazol-1-yl)acetyl]-N-cyclopropylpyrrolidine-2-carboxamide?
The canonical SMILES for 1-[2-(4-aminopyrazol-1-yl)acetyl]-N-cyclopropylpyrrolidine-2-carboxamide is Nc1cnn(CC(=O)N2CCCC2C(=O)NC2CC2)c1.
What is the InChIKey of 1-[2-(4-aminopyrazol-1-yl)acetyl]-N-cyclopropylpyrrolidine-2-carboxamide?
The InChIKey is FTJUCLUPAMGWBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N5O2/c14-9-6-15-17(7-9)8-12(19)18-5-1-2-11(18)13(20)16-10-3-4-10/h6-7,10-11H,1-5,8,14H2,(H,16,20).
What are the key properties of 1-[2-(4-aminopyrazol-1-yl)acetyl]-N-cyclopropylpyrrolidine-2-carboxamide?
1-[2-(4-aminopyrazol-1-yl)acetyl]-N-cyclopropylpyrrolidine-2-carboxamide has a molecular weight of 277.33 g/mol, XLogP of -0.27, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-aminopyrazol-1-yl)acetyl]-N-cyclopropylpyrrolidine-2-carboxamide is sourced from PubChem (CID 61104989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).