1-[2-(4-aminopyrazol-1-yl)ethyl]pyrrolidine-2-carboxamide

C10H17N5O — CID 62137875

IUPAC1-[2-(4-aminopyrazol-1-yl)ethyl]pyrrolidine-2-carboxamide
SMILESNC(=O)C1CCCN1CCn1cc(N)cn1
InChIInChI=1S/C10H17N5O/c11-8-6-13-15(7-8)5-4-14-3-1-2-9(14)10(12)16/h6-7,9H,1-5,11H2,(H2,12,16)
InChIKeyHVXLBPHVLWXHQM-UHFFFAOYSA-N
MW223.28 g/mol
LogP-0.58
Rot. Bonds4

About 1-[2-(4-aminopyrazol-1-yl)ethyl]pyrrolidine-2-carboxamide

1-[2-(4-aminopyrazol-1-yl)ethyl]pyrrolidine-2-carboxamide (PubChem CID 62137875) has the molecular formula C10H17N5O and a molecular weight of 223.28 g/mol. Its IUPAC name is 1-[2-(4-aminopyrazol-1-yl)ethyl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-[2-(4-aminopyrazol-1-yl)ethyl]pyrrolidine-2-carboxamide
PubChem CID62137875
Molecular FormulaC10H17N5O
Molecular Weight223.28 g/mol
Exact Mass223.14
IUPAC Name1-[2-(4-aminopyrazol-1-yl)ethyl]pyrrolidine-2-carboxamide
SMILESNC(=O)C1CCCN1CCn1cc(N)cn1
InChIInChI=1S/C10H17N5O/c11-8-6-13-15(7-8)5-4-14-3-1-2-9(14)10(12)16/h6-7,9H,1-5,11H2,(H2,12,16)
InChIKeyHVXLBPHVLWXHQM-UHFFFAOYSA-N
XLogP-0.58
TPSA90.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 5-0.58
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)ethyl]pyrrolidine-2-carboxamide?
The IUPAC name of 1-[2-(4-aminopyrazol-1-yl)ethyl]pyrrolidine-2-carboxamide (CID 62137875) is 1-[2-(4-aminopyrazol-1-yl)ethyl]pyrrolidine-2-carboxamide.
What is the SMILES notation for 1-[2-(4-aminopyrazol-1-yl)ethyl]pyrrolidine-2-carboxamide?
The canonical SMILES for 1-[2-(4-aminopyrazol-1-yl)ethyl]pyrrolidine-2-carboxamide is NC(=O)C1CCCN1CCn1cc(N)cn1.
What is the InChIKey of 1-[2-(4-aminopyrazol-1-yl)ethyl]pyrrolidine-2-carboxamide?
The InChIKey is HVXLBPHVLWXHQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5O/c11-8-6-13-15(7-8)5-4-14-3-1-2-9(14)10(12)16/h6-7,9H,1-5,11H2,(H2,12,16).
What are the key properties of 1-[2-(4-aminopyrazol-1-yl)ethyl]pyrrolidine-2-carboxamide?
1-[2-(4-aminopyrazol-1-yl)ethyl]pyrrolidine-2-carboxamide has a molecular weight of 223.28 g/mol, XLogP of -0.58, 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)ethyl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 62137875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).