3-[(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)amino]pyrazine-2-carboxamide

Name: 3-[(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)amino]pyrazine-2-carboxamide — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₅H₁₉N₅OS — CID 126829572

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC3-[(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)amino]pyrazine-2-carboxamide

SMILESNC(=O)c1nccnc1NCC(c1cccs1)N1CCCC1

InChIInChI=1S/C15H19N5OS/c16-14(21)13-15(18-6-5-17-13)19-10-11(12-4-3-9-22-12)20-7-1-2-8-20/h3-6,9,11H,1-2,7-8,10H2,(H2,16,21)(H,18,19)

InChIKeyAFCNTGLALPLCNE-UHFFFAOYSA-N

MW317.42 g/mol

LogP1.89

Rot. Bonds6

About 3-[(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)amino]pyrazine-2-carboxamide

3-[(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)amino]pyrazine-2-carboxamide (PubChem CID 126829572) has the molecular formula C₁₅H₁₉N₅OS and a molecular weight of 317.42 g/mol. Its IUPAC name is 3-[(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)amino]pyrazine-2-carboxamide.

Molecular Properties

Compound Name	3-[(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)amino]pyrazine-2-carboxamide
PubChem CID	126829572
Molecular Formula	C₁₅H₁₉N₅OS
Molecular Weight	317.42 g/mol
Exact Mass	317.13
IUPAC Name	3-[(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)amino]pyrazine-2-carboxamide
SMILES	NC(=O)c1nccnc1NCC(c1cccs1)N1CCCC1
InChI	InChI=1S/C15H19N5OS/c16-14(21)13-15(18-6-5-17-13)19-10-11(12-4-3-9-22-12)20-7-1-2-8-20/h3-6,9,11H,1-2,7-8,10H2,(H2,16,21)(H,18,19)
InChIKey	AFCNTGLALPLCNE-UHFFFAOYSA-N
XLogP	1.89
TPSA	84.14 Å²
H-Bond Donors	2
H-Bond Acceptors	6
Rotatable Bonds	6
Heavy Atoms	22
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	317.42
LogP ≤ 5	1.89
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 3-[(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)amino]pyrazine-2-carboxamide?

The IUPAC name of 3-[(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)amino]pyrazine-2-carboxamide (CID 126829572) is 3-[(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)amino]pyrazine-2-carboxamide.

What is the SMILES notation for 3-[(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)amino]pyrazine-2-carboxamide?

The canonical SMILES for 3-[(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)amino]pyrazine-2-carboxamide is NC(=O)c1nccnc1NCC(c1cccs1)N1CCCC1.

What is the InChIKey of 3-[(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)amino]pyrazine-2-carboxamide?

The InChIKey is AFCNTGLALPLCNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5OS/c16-14(21)13-15(18-6-5-17-13)19-10-11(12-4-3-9-22-12)20-7-1-2-8-20/h3-6,9,11H,1-2,7-8,10H2,(H2,16,21)(H,18,19).

What are the key properties of 3-[(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)amino]pyrazine-2-carboxamide?

3-[(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)amino]pyrazine-2-carboxamide has a molecular weight of 317.42 g/mol, XLogP of 1.89, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)amino]pyrazine-2-carboxamide is sourced from PubChem (CID 126829572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 126829572 — identifiers, structure, computed properties (public domain)

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