4-ethoxy-N-pyrazin-2-ylbutanamide

C10H15N3O2 — CID 86794503

IUPAC4-ethoxy-N-pyrazin-2-ylbutanamide
SMILESCCOCCCC(=O)Nc1cnccn1
InChIInChI=1S/C10H15N3O2/c1-2-15-7-3-4-10(14)13-9-8-11-5-6-12-9/h5-6,8H,2-4,7H2,1H3,(H,12,13,14)
InChIKeyVSKCUDMIYUNKMO-UHFFFAOYSA-N
MW209.25 g/mol
LogP1.23
Rot. Bonds6

About 4-ethoxy-N-pyrazin-2-ylbutanamide

4-ethoxy-N-pyrazin-2-ylbutanamide (PubChem CID 86794503) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is 4-ethoxy-N-pyrazin-2-ylbutanamide.

Molecular Properties

Compound Name4-ethoxy-N-pyrazin-2-ylbutanamide
PubChem CID86794503
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Name4-ethoxy-N-pyrazin-2-ylbutanamide
SMILESCCOCCCC(=O)Nc1cnccn1
InChIInChI=1S/C10H15N3O2/c1-2-15-7-3-4-10(14)13-9-8-11-5-6-12-9/h5-6,8H,2-4,7H2,1H3,(H,12,13,14)
InChIKeyVSKCUDMIYUNKMO-UHFFFAOYSA-N
XLogP1.23
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-pyrazin-2-ylpentanamide
CID 91469646
5-methoxy-N-pyrazin-2-ylpentanamide
CID 75485096
3-methoxy-N-pyrazin-2-ylpropanamide
CID 127118096
N',N'-diethyl-N-pyrazin-2-ylbutanediamide
CID 75508705
N-(4,5-dichloro-2-pyridinyl)-4-ethoxybutanamide
CID 71987137
N-(5-bromo-2-pyridinyl)-4-ethoxybutanamide
CID 112729128
4-ethoxy-N-[4-(4-hydroxybut-1-ynyl)-2-pyridinyl]butanamide
CID 102821220
4-ethoxy-N-phenylbutanamide
CID 112728021
2-(cyclopropylmethoxy)-N-pyrazin-2-ylacetamide
CID 86794489
N-(6-chloro-5-methyl-3-pyridinyl)-4-ethoxybutanamide
CID 103730322
4-ethoxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)butanamide
CID 71999021
tert-butyl N-[3-oxo-3-(pyrazin-2-ylamino)propyl]carbamate
CID 122135229

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-N-pyrazin-2-ylbutanamide?
The IUPAC name of 4-ethoxy-N-pyrazin-2-ylbutanamide (CID 86794503) is 4-ethoxy-N-pyrazin-2-ylbutanamide.
What is the SMILES notation for 4-ethoxy-N-pyrazin-2-ylbutanamide?
The canonical SMILES for 4-ethoxy-N-pyrazin-2-ylbutanamide is CCOCCCC(=O)Nc1cnccn1.
What is the InChIKey of 4-ethoxy-N-pyrazin-2-ylbutanamide?
The InChIKey is VSKCUDMIYUNKMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-2-15-7-3-4-10(14)13-9-8-11-5-6-12-9/h5-6,8H,2-4,7H2,1H3,(H,12,13,14).
What are the key properties of 4-ethoxy-N-pyrazin-2-ylbutanamide?
4-ethoxy-N-pyrazin-2-ylbutanamide has a molecular weight of 209.25 g/mol, XLogP of 1.23, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-N-pyrazin-2-ylbutanamide is sourced from PubChem (CID 86794503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).