N-[2-(1H-indol-3-yl)ethyl]pyrazine-2-carboxamide

C15H14N4O — CID 2537513

IUPACN-[2-(1H-indol-3-yl)ethyl]pyrazine-2-carboxamide
SMILESO=C(NCCc1c[nH]c2ccccc12)c1cnccn1
InChIInChI=1S/C15H14N4O/c20-15(14-10-16-7-8-17-14)18-6-5-11-9-19-13-4-2-1-3-12(11)13/h1-4,7-10,19H,5-6H2,(H,18,20)
InChIKeyXHZHVKZMLSMJMV-UHFFFAOYSA-N
MW266.30 g/mol
LogP1.93
Rot. Bonds4

About N-[2-(1H-indol-3-yl)ethyl]pyrazine-2-carboxamide

N-[2-(1H-indol-3-yl)ethyl]pyrazine-2-carboxamide (PubChem CID 2537513) has the molecular formula C15H14N4O and a molecular weight of 266.30 g/mol. Its IUPAC name is N-[2-(1H-indol-3-yl)ethyl]pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(1H-indol-3-yl)ethyl]pyrazine-2-carboxamide
PubChem CID2537513
Molecular FormulaC15H14N4O
Molecular Weight266.30 g/mol
Exact Mass266.12
IUPAC NameN-[2-(1H-indol-3-yl)ethyl]pyrazine-2-carboxamide
SMILESO=C(NCCc1c[nH]c2ccccc12)c1cnccn1
InChIInChI=1S/C15H14N4O/c20-15(14-10-16-7-8-17-14)18-6-5-11-9-19-13-4-2-1-3-12(11)13/h1-4,7-10,19H,5-6H2,(H,18,20)
InChIKeyXHZHVKZMLSMJMV-UHFFFAOYSA-N
XLogP1.93
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(1H-indol-3-yl)ethyl]pyrazine-2-carboxamide?
The IUPAC name of N-[2-(1H-indol-3-yl)ethyl]pyrazine-2-carboxamide (CID 2537513) is N-[2-(1H-indol-3-yl)ethyl]pyrazine-2-carboxamide.
What is the SMILES notation for N-[2-(1H-indol-3-yl)ethyl]pyrazine-2-carboxamide?
The canonical SMILES for N-[2-(1H-indol-3-yl)ethyl]pyrazine-2-carboxamide is O=C(NCCc1c[nH]c2ccccc12)c1cnccn1.
What is the InChIKey of N-[2-(1H-indol-3-yl)ethyl]pyrazine-2-carboxamide?
The InChIKey is XHZHVKZMLSMJMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O/c20-15(14-10-16-7-8-17-14)18-6-5-11-9-19-13-4-2-1-3-12(11)13/h1-4,7-10,19H,5-6H2,(H,18,20).
What are the key properties of N-[2-(1H-indol-3-yl)ethyl]pyrazine-2-carboxamide?
N-[2-(1H-indol-3-yl)ethyl]pyrazine-2-carboxamide has a molecular weight of 266.30 g/mol, XLogP of 1.93, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1H-indol-3-yl)ethyl]pyrazine-2-carboxamide is sourced from PubChem (CID 2537513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).