N-(furan-2-ylmethyl)-5-(2-methoxyanilino)pyrazine-2-carboxamide

C17H16N4O3 — CID 109279400

IUPACN-(furan-2-ylmethyl)-5-(2-methoxyanilino)pyrazine-2-carboxamide
SMILESCOc1ccccc1Nc1cnc(C(=O)NCc2ccco2)cn1
InChIInChI=1S/C17H16N4O3/c1-23-15-7-3-2-6-13(15)21-16-11-18-14(10-19-16)17(22)20-9-12-5-4-8-24-12/h2-8,10-11H,9H2,1H3,(H,19,21)(H,20,22)
InChIKeyZFTIXCMOSWVXBC-UHFFFAOYSA-N
MW324.34 g/mol
LogP2.75
Rot. Bonds6

About N-(furan-2-ylmethyl)-5-(2-methoxyanilino)pyrazine-2-carboxamide

N-(furan-2-ylmethyl)-5-(2-methoxyanilino)pyrazine-2-carboxamide (PubChem CID 109279400) has the molecular formula C17H16N4O3 and a molecular weight of 324.34 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-5-(2-methoxyanilino)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-5-(2-methoxyanilino)pyrazine-2-carboxamide
PubChem CID109279400
Molecular FormulaC17H16N4O3
Molecular Weight324.34 g/mol
Exact Mass324.12
IUPAC NameN-(furan-2-ylmethyl)-5-(2-methoxyanilino)pyrazine-2-carboxamide
SMILESCOc1ccccc1Nc1cnc(C(=O)NCc2ccco2)cn1
InChIInChI=1S/C17H16N4O3/c1-23-15-7-3-2-6-13(15)21-16-11-18-14(10-19-16)17(22)20-9-12-5-4-8-24-12/h2-8,10-11H,9H2,1H3,(H,19,21)(H,20,22)
InChIKeyZFTIXCMOSWVXBC-UHFFFAOYSA-N
XLogP2.75
TPSA89.28 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.34
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(furan-2-ylmethyl)-5-(3,4,5-trimethoxyanilino)pyrazine-2-carboxamide
CID 109279444
N-benzyl-5-(2-methoxyanilino)pyrazine-2-carboxamide
CID 109279734
5-(2,4-dimethylanilino)-N-(furan-2-ylmethyl)pyrazine-2-carboxamide
CID 109279368
5-(3,4-dimethylanilino)-N-(furan-2-ylmethyl)pyrazine-2-carboxamide
CID 109279370
5-(4-bromo-2-methylanilino)-N-(furan-2-ylmethyl)pyrazine-2-carboxamide
CID 109279436
N-(furan-2-ylmethyl)-2-(2-methoxyanilino)-6-methylpyrimidine-4-carboxamide
CID 109327013
5-(4-tert-butylanilino)-N-(furan-2-ylmethyl)pyrazine-2-carboxamide
CID 109279384
N-[(2-methoxyphenyl)methyl]-5-(2-propan-2-yloxyanilino)pyrazine-2-carboxamide
CID 109282251
5-(2-fluoroanilino)-N-[(2-methoxyphenyl)methyl]pyrazine-2-carboxamide
CID 109282232
N-[2-(2-fluorophenyl)ethyl]-5-(2-methoxyanilino)pyrazine-2-carboxamide
CID 109284290
5-(2,4-dimethoxyanilino)-N-[(2-methoxyphenyl)methyl]pyrazine-2-carboxamide
CID 109282254
6-(5-chloro-2-methoxyanilino)-N-(furan-2-ylmethyl)pyrimidine-4-carboxamide
CID 109346394

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-5-(2-methoxyanilino)pyrazine-2-carboxamide?
The IUPAC name of N-(furan-2-ylmethyl)-5-(2-methoxyanilino)pyrazine-2-carboxamide (CID 109279400) is N-(furan-2-ylmethyl)-5-(2-methoxyanilino)pyrazine-2-carboxamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-5-(2-methoxyanilino)pyrazine-2-carboxamide?
The canonical SMILES for N-(furan-2-ylmethyl)-5-(2-methoxyanilino)pyrazine-2-carboxamide is COc1ccccc1Nc1cnc(C(=O)NCc2ccco2)cn1.
What is the InChIKey of N-(furan-2-ylmethyl)-5-(2-methoxyanilino)pyrazine-2-carboxamide?
The InChIKey is ZFTIXCMOSWVXBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4O3/c1-23-15-7-3-2-6-13(15)21-16-11-18-14(10-19-16)17(22)20-9-12-5-4-8-24-12/h2-8,10-11H,9H2,1H3,(H,19,21)(H,20,22).
What are the key properties of N-(furan-2-ylmethyl)-5-(2-methoxyanilino)pyrazine-2-carboxamide?
N-(furan-2-ylmethyl)-5-(2-methoxyanilino)pyrazine-2-carboxamide has a molecular weight of 324.34 g/mol, XLogP of 2.75, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-5-(2-methoxyanilino)pyrazine-2-carboxamide is sourced from PubChem (CID 109279400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).