2-ethyl-3-methoxy-N-(2-oxo-2-pyrazin-2-ylethyl)benzamide

C16H17N3O3 — CID 161137524

IUPAC2-ethyl-3-methoxy-N-(2-oxo-2-pyrazin-2-ylethyl)benzamide
SMILESCCc1c(OC)cccc1C(=O)NCC(=O)c1cnccn1
InChIInChI=1S/C16H17N3O3/c1-3-11-12(5-4-6-15(11)22-2)16(21)19-10-14(20)13-9-17-7-8-18-13/h4-9H,3,10H2,1-2H3,(H,19,21)
InChIKeyFAOZQTYSJAVIJB-UHFFFAOYSA-N
MW299.33 g/mol
LogP1.66
Rot. Bonds6

About 2-ethyl-3-methoxy-N-(2-oxo-2-pyrazin-2-ylethyl)benzamide

2-ethyl-3-methoxy-N-(2-oxo-2-pyrazin-2-ylethyl)benzamide (PubChem CID 161137524) has the molecular formula C16H17N3O3 and a molecular weight of 299.33 g/mol. Its IUPAC name is 2-ethyl-3-methoxy-N-(2-oxo-2-pyrazin-2-ylethyl)benzamide.

Molecular Properties

Compound Name2-ethyl-3-methoxy-N-(2-oxo-2-pyrazin-2-ylethyl)benzamide
PubChem CID161137524
Molecular FormulaC16H17N3O3
Molecular Weight299.33 g/mol
Exact Mass299.13
IUPAC Name2-ethyl-3-methoxy-N-(2-oxo-2-pyrazin-2-ylethyl)benzamide
SMILESCCc1c(OC)cccc1C(=O)NCC(=O)c1cnccn1
InChIInChI=1S/C16H17N3O3/c1-3-11-12(5-4-6-15(11)22-2)16(21)19-10-14(20)13-9-17-7-8-18-13/h4-9H,3,10H2,1-2H3,(H,19,21)
InChIKeyFAOZQTYSJAVIJB-UHFFFAOYSA-N
XLogP1.66
TPSA81.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.33
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3,3-dimethyl-1-oxo-1-pyrazin-2-ylbutan-2-yl)-2-ethyl-3-methoxybenzamide
CID 71261556
N-[(2-methoxyphenyl)methyl]-N-methylpyrazine-2-carboxamide
CID 31234095
2-(2-ethyl-3-methoxyphenyl)-2-oxoacetic acid
CID 67245601
N-[2-(2-methoxyphenyl)-2-oxoethyl]-3-pyridin-4-yloxybenzamide
CID 167964840
N-[2-(2-ethylanilino)-2-oxoethyl]pyrazine-2-carboxamide
CID 27762226
N-(2,4-difluorophenyl)-2-ethyl-3-methoxybenzamide
CID 135296532
N-[2-(ethylamino)-2-oxoethyl]-2-methoxybenzamide
CID 2687892
N-[(2-chloro-6-methoxyphenyl)methyl]-4-(methylamino)pyridine-3-carboxamide
CID 103293346
N'-(2,4,5-trimethoxybenzoyl)pyrazine-2-carbohydrazide
CID 42016001
2-ethyl-3-methoxybenzenecarbothioamide
CID 91875220
4-methoxy-1-pyrazin-2-ylbutan-1-one
CID 62620232
N-(2-methylprop-2-enyl)pyrazine-2-carboxamide
CID 114618266

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-3-methoxy-N-(2-oxo-2-pyrazin-2-ylethyl)benzamide?
The IUPAC name of 2-ethyl-3-methoxy-N-(2-oxo-2-pyrazin-2-ylethyl)benzamide (CID 161137524) is 2-ethyl-3-methoxy-N-(2-oxo-2-pyrazin-2-ylethyl)benzamide.
What is the SMILES notation for 2-ethyl-3-methoxy-N-(2-oxo-2-pyrazin-2-ylethyl)benzamide?
The canonical SMILES for 2-ethyl-3-methoxy-N-(2-oxo-2-pyrazin-2-ylethyl)benzamide is CCc1c(OC)cccc1C(=O)NCC(=O)c1cnccn1.
What is the InChIKey of 2-ethyl-3-methoxy-N-(2-oxo-2-pyrazin-2-ylethyl)benzamide?
The InChIKey is FAOZQTYSJAVIJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O3/c1-3-11-12(5-4-6-15(11)22-2)16(21)19-10-14(20)13-9-17-7-8-18-13/h4-9H,3,10H2,1-2H3,(H,19,21).
What are the key properties of 2-ethyl-3-methoxy-N-(2-oxo-2-pyrazin-2-ylethyl)benzamide?
2-ethyl-3-methoxy-N-(2-oxo-2-pyrazin-2-ylethyl)benzamide has a molecular weight of 299.33 g/mol, XLogP of 1.66, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-3-methoxy-N-(2-oxo-2-pyrazin-2-ylethyl)benzamide is sourced from PubChem (CID 161137524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).