N-[2-(pyrazin-2-ylmethylamino)ethyl]acetamide

C9H14N4O — CID 62763041

IUPACN-[2-(pyrazin-2-ylmethylamino)ethyl]acetamide
SMILESCC(=O)NCCNCc1cnccn1
InChIInChI=1S/C9H14N4O/c1-8(14)12-4-2-10-6-9-7-11-3-5-13-9/h3,5,7,10H,2,4,6H2,1H3,(H,12,14)
InChIKeyFEJBGBDZAGUIDO-UHFFFAOYSA-N
MW194.24 g/mol
LogP-0.30
Rot. Bonds5

About N-[2-(pyrazin-2-ylmethylamino)ethyl]acetamide

N-[2-(pyrazin-2-ylmethylamino)ethyl]acetamide (PubChem CID 62763041) has the molecular formula C9H14N4O and a molecular weight of 194.24 g/mol. Its IUPAC name is N-[2-(pyrazin-2-ylmethylamino)ethyl]acetamide.

Molecular Properties

Compound NameN-[2-(pyrazin-2-ylmethylamino)ethyl]acetamide
PubChem CID62763041
Molecular FormulaC9H14N4O
Molecular Weight194.24 g/mol
Exact Mass194.12
IUPAC NameN-[2-(pyrazin-2-ylmethylamino)ethyl]acetamide
SMILESCC(=O)NCCNCc1cnccn1
InChIInChI=1S/C9H14N4O/c1-8(14)12-4-2-10-6-9-7-11-3-5-13-9/h3,5,7,10H,2,4,6H2,1H3,(H,12,14)
InChIKeyFEJBGBDZAGUIDO-UHFFFAOYSA-N
XLogP-0.30
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.24
LogP ≤ 5-0.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[2-(pyrazin-2-ylmethylamino)ethyl]acetamide?
The IUPAC name of N-[2-(pyrazin-2-ylmethylamino)ethyl]acetamide (CID 62763041) is N-[2-(pyrazin-2-ylmethylamino)ethyl]acetamide.
What is the SMILES notation for N-[2-(pyrazin-2-ylmethylamino)ethyl]acetamide?
The canonical SMILES for N-[2-(pyrazin-2-ylmethylamino)ethyl]acetamide is CC(=O)NCCNCc1cnccn1.
What is the InChIKey of N-[2-(pyrazin-2-ylmethylamino)ethyl]acetamide?
The InChIKey is FEJBGBDZAGUIDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4O/c1-8(14)12-4-2-10-6-9-7-11-3-5-13-9/h3,5,7,10H,2,4,6H2,1H3,(H,12,14).
What are the key properties of N-[2-(pyrazin-2-ylmethylamino)ethyl]acetamide?
N-[2-(pyrazin-2-ylmethylamino)ethyl]acetamide has a molecular weight of 194.24 g/mol, XLogP of -0.30, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(pyrazin-2-ylmethylamino)ethyl]acetamide is sourced from PubChem (CID 62763041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).