3-amino-N-(2-hydroxyethyl)-6-(3-methoxyphenyl)pyrazine-2-carboxamide

C14H16N4O3 — CID 121004737

IUPAC3-amino-N-(2-hydroxyethyl)-6-(3-methoxyphenyl)pyrazine-2-carboxamide
SMILESCOc1cccc(-c2cnc(N)c(C(=O)NCCO)n2)c1
InChIInChI=1S/C14H16N4O3/c1-21-10-4-2-3-9(7-10)11-8-17-13(15)12(18-11)14(20)16-5-6-19/h2-4,7-8,19H,5-6H2,1H3,(H2,15,17)(H,16,20)
InChIKeyFMZVVUPAFLKWFJ-UHFFFAOYSA-N
MW288.31 g/mol
LogP0.46
Rot. Bonds5

About 3-amino-N-(2-hydroxyethyl)-6-(3-methoxyphenyl)pyrazine-2-carboxamide

3-amino-N-(2-hydroxyethyl)-6-(3-methoxyphenyl)pyrazine-2-carboxamide (PubChem CID 121004737) has the molecular formula C14H16N4O3 and a molecular weight of 288.31 g/mol. Its IUPAC name is 3-amino-N-(2-hydroxyethyl)-6-(3-methoxyphenyl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-(2-hydroxyethyl)-6-(3-methoxyphenyl)pyrazine-2-carboxamide
PubChem CID121004737
Molecular FormulaC14H16N4O3
Molecular Weight288.31 g/mol
Exact Mass288.12
IUPAC Name3-amino-N-(2-hydroxyethyl)-6-(3-methoxyphenyl)pyrazine-2-carboxamide
SMILESCOc1cccc(-c2cnc(N)c(C(=O)NCCO)n2)c1
InChIInChI=1S/C14H16N4O3/c1-21-10-4-2-3-9(7-10)11-8-17-13(15)12(18-11)14(20)16-5-6-19/h2-4,7-8,19H,5-6H2,1H3,(H2,15,17)(H,16,20)
InChIKeyFMZVVUPAFLKWFJ-UHFFFAOYSA-N
XLogP0.46
TPSA110.36 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.31
LogP ≤ 50.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

3-amino-6-(3-methoxyphenyl)-N-phenylpyrazine-2-carboxamide
CID 52937360
N-(2-acetamidoethyl)-3-amino-6-phenylpyrazine-2-carboxamide
CID 10402476
3-amino-N-(2,5-dimethoxyphenyl)-6-pyridin-3-ylpyrazine-2-carboxamide;molecular hydrogen
CID 159900740
3-amino-N-methyl-6-(3-methylphenyl)pyrazine-2-carboxamide
CID 10331970
3-amino-6-(3-ethoxyphenyl)-N-[4-(propylamino)-3-pyridinyl]pyrazine-2-carboxamide
CID 155689401
N-(2-hydroxyethyl)-3-[1-(4-methoxyphenyl)-2-oxo-3H-imidazo[4,5-b]pyrazin-5-yl]benzamide
CID 126470712
3-amino-6-(3-aminophenyl)-N-butan-2-ylpyrazine-2-carboxamide
CID 122185569
3-[6-amino-5-(3,4,5-trimethoxyphenyl)-3-pyridinyl]-N-(2-hydroxyethyl)benzamide
CID 126672906
3-(5-amino-6-morpholin-4-ylpyrazin-2-yl)-N-(2-hydroxyethyl)benzamide
CID 126475128
3-amino-6-[3-[[[(1S)-2,3-dihydro-1H-inden-1-yl]amino]methyl]phenyl]-N-(4-hydroxybutyl)pyrazine-2-carboxamide
CID 68651636
methyl 2-[[5-methoxy-2-(3-methoxyphenyl)-1,7-naphthyridine-6-carbonyl]amino]acetate
CID 163955322
3-amino-6-(3-carbamimidoylphenyl)-N-methylpyrazine-2-carboxamide
CID 68650453

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2-hydroxyethyl)-6-(3-methoxyphenyl)pyrazine-2-carboxamide?
The IUPAC name of 3-amino-N-(2-hydroxyethyl)-6-(3-methoxyphenyl)pyrazine-2-carboxamide (CID 121004737) is 3-amino-N-(2-hydroxyethyl)-6-(3-methoxyphenyl)pyrazine-2-carboxamide.
What is the SMILES notation for 3-amino-N-(2-hydroxyethyl)-6-(3-methoxyphenyl)pyrazine-2-carboxamide?
The canonical SMILES for 3-amino-N-(2-hydroxyethyl)-6-(3-methoxyphenyl)pyrazine-2-carboxamide is COc1cccc(-c2cnc(N)c(C(=O)NCCO)n2)c1.
What is the InChIKey of 3-amino-N-(2-hydroxyethyl)-6-(3-methoxyphenyl)pyrazine-2-carboxamide?
The InChIKey is FMZVVUPAFLKWFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O3/c1-21-10-4-2-3-9(7-10)11-8-17-13(15)12(18-11)14(20)16-5-6-19/h2-4,7-8,19H,5-6H2,1H3,(H2,15,17)(H,16,20).
What are the key properties of 3-amino-N-(2-hydroxyethyl)-6-(3-methoxyphenyl)pyrazine-2-carboxamide?
3-amino-N-(2-hydroxyethyl)-6-(3-methoxyphenyl)pyrazine-2-carboxamide has a molecular weight of 288.31 g/mol, XLogP of 0.46, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-hydroxyethyl)-6-(3-methoxyphenyl)pyrazine-2-carboxamide is sourced from PubChem (CID 121004737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).