3-amino-N-(2,5-dimethoxyphenyl)-6-pyridin-3-ylpyrazine-2-carboxamide;molecular hydrogen

C18H23N5O3 — CID 159900740

IUPAC3-amino-N-(2,5-dimethoxyphenyl)-6-pyridin-3-ylpyrazine-2-carboxamide;molecular hydrogen
SMILESCOc1ccc(OC)c(NC(=O)c2nc(-c3cccnc3)cnc2N)c1.[H][H].[H][H].[H][H]
InChIInChI=1S/C18H17N5O3.3H2/c1-25-12-5-6-15(26-2)13(8-12)23-18(24)16-17(19)21-10-14(22-16)11-4-3-7-20-9-11;;;/h3-10H,1-2H3,(H2,19,21)(H,23,24);3*1H
InChIKeyNVXPRWVXRZNNIN-UHFFFAOYSA-N
MW357.41 g/mol
LogP3.13
Rot. Bonds5

About 3-amino-N-(2,5-dimethoxyphenyl)-6-pyridin-3-ylpyrazine-2-carboxamide;molecular hydrogen

3-amino-N-(2,5-dimethoxyphenyl)-6-pyridin-3-ylpyrazine-2-carboxamide;molecular hydrogen (PubChem CID 159900740) has the molecular formula C18H23N5O3 and a molecular weight of 357.41 g/mol. Its IUPAC name is 3-amino-N-(2,5-dimethoxyphenyl)-6-pyridin-3-ylpyrazine-2-carboxamide;molecular hydrogen.

Molecular Properties

Compound Name3-amino-N-(2,5-dimethoxyphenyl)-6-pyridin-3-ylpyrazine-2-carboxamide;molecular hydrogen
PubChem CID159900740
Molecular FormulaC18H23N5O3
Molecular Weight357.41 g/mol
Exact Mass357.18
IUPAC Name3-amino-N-(2,5-dimethoxyphenyl)-6-pyridin-3-ylpyrazine-2-carboxamide;molecular hydrogen
SMILESCOc1ccc(OC)c(NC(=O)c2nc(-c3cccnc3)cnc2N)c1.[H][H].[H][H].[H][H]
InChIInChI=1S/C18H17N5O3.3H2/c1-25-12-5-6-15(26-2)13(8-12)23-18(24)16-17(19)21-10-14(22-16)11-4-3-7-20-9-11;;;/h3-10H,1-2H3,(H2,19,21)(H,23,24);3*1H
InChIKeyNVXPRWVXRZNNIN-UHFFFAOYSA-N
XLogP3.13
TPSA112.25 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.41
LogP ≤ 53.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

3-amino-N-(1H-indol-6-yl)-6-pyridin-3-ylpyrazine-2-carboxamide;3-amino-N-(2-methoxy-5-methylphenyl)-6-pyridin-3-ylpyrazine-2-carboxamide;3-amino-N-(2-methoxyphenyl)-6-pyridin-3-ylpyrazine-2-carboxamide;N-(2,5-dimethoxyphenyl)-3-methyl-6-pyridin-3-ylpyrazine-2-carboxamide;molecular hydrogen
CID 159000788
N-(5-acetamido-2-methoxyphenyl)-3-methyl-6-pyridin-3-ylpyrazine-2-carboxamide;molecular hydrogen
CID 157383195
3-amino-6-(3-methoxyphenyl)-N-phenylpyrazine-2-carboxamide
CID 52937360
3-amino-N-(2-hydroxyethyl)-6-(3-methoxyphenyl)pyrazine-2-carboxamide
CID 121004737
N-(5-acetamido-2-methoxyphenyl)-3-methyl-6-pyridin-3-ylpyrazine-2-carboxamide;3-amino-N-(2,2-difluoro-1,3-benzodioxol-4-yl)-6-pyridin-3-ylpyrazine-2-carboxamide;3-amino-N-pyridin-2-yl-6-pyridin-3-ylpyrazine-2-carboxamide;3-amino-6-pyridin-3-yl-N-pyridin-4-ylpyrazine-2-carboxamide;molecular hydrogen
CID 159074778
N-(2,5-dimethoxyphenyl)isoquinoline-3-carboxamide
CID 110860541
4-amino-N-(2,5-dimethoxyphenyl)-1,2,5-oxadiazole-3-carboxamide
CID 62688302
3-[(2,5-dimethoxyphenyl)carbamoyl]pyrazine-2-carboxylic acid
CID 20866752
3-amino-N-(1-methylindol-6-yl)-6-pyridin-3-ylpyrazine-2-carboxamide
CID 130206369
3-amino-N-(1H-indol-5-yl)-6-pyridin-3-ylpyrazine-2-carboxamide
CID 46834031
3-amino-N-(1H-indol-6-yl)-6-pyridin-3-ylpyrazine-2-carboxamide
CID 59471623
6-amino-N-(2,5-dimethoxyphenyl)pyridine-2-carboxamide
CID 62241119

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2,5-dimethoxyphenyl)-6-pyridin-3-ylpyrazine-2-carboxamide;molecular hydrogen?
The IUPAC name of 3-amino-N-(2,5-dimethoxyphenyl)-6-pyridin-3-ylpyrazine-2-carboxamide;molecular hydrogen (CID 159900740) is 3-amino-N-(2,5-dimethoxyphenyl)-6-pyridin-3-ylpyrazine-2-carboxamide;molecular hydrogen.
What is the SMILES notation for 3-amino-N-(2,5-dimethoxyphenyl)-6-pyridin-3-ylpyrazine-2-carboxamide;molecular hydrogen?
The canonical SMILES for 3-amino-N-(2,5-dimethoxyphenyl)-6-pyridin-3-ylpyrazine-2-carboxamide;molecular hydrogen is COc1ccc(OC)c(NC(=O)c2nc(-c3cccnc3)cnc2N)c1.[H][H].[H][H].[H][H].
What is the InChIKey of 3-amino-N-(2,5-dimethoxyphenyl)-6-pyridin-3-ylpyrazine-2-carboxamide;molecular hydrogen?
The InChIKey is NVXPRWVXRZNNIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N5O3.3H2/c1-25-12-5-6-15(26-2)13(8-12)23-18(24)16-17(19)21-10-14(22-16)11-4-3-7-20-9-11;;;/h3-10H,1-2H3,(H2,19,21)(H,23,24);3*1H.
What are the key properties of 3-amino-N-(2,5-dimethoxyphenyl)-6-pyridin-3-ylpyrazine-2-carboxamide;molecular hydrogen?
3-amino-N-(2,5-dimethoxyphenyl)-6-pyridin-3-ylpyrazine-2-carboxamide;molecular hydrogen has a molecular weight of 357.41 g/mol, XLogP of 3.13, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2,5-dimethoxyphenyl)-6-pyridin-3-ylpyrazine-2-carboxamide;molecular hydrogen is sourced from PubChem (CID 159900740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).