5-(benzylamino)-N-(2-methoxyphenyl)pyrazine-2-carboxamide

C19H18N4O2 — CID 109279891

IUPAC5-(benzylamino)-N-(2-methoxyphenyl)pyrazine-2-carboxamide
SMILESCOc1ccccc1NC(=O)c1cnc(NCc2ccccc2)cn1
InChIInChI=1S/C19H18N4O2/c1-25-17-10-6-5-9-15(17)23-19(24)16-12-22-18(13-20-16)21-11-14-7-3-2-4-8-14/h2-10,12-13H,11H2,1H3,(H,21,22)(H,23,24)
InChIKeyMKDKZBFFESHUNS-UHFFFAOYSA-N
MW334.38 g/mol
LogP3.35
Rot. Bonds6

About 5-(benzylamino)-N-(2-methoxyphenyl)pyrazine-2-carboxamide

5-(benzylamino)-N-(2-methoxyphenyl)pyrazine-2-carboxamide (PubChem CID 109279891) has the molecular formula C19H18N4O2 and a molecular weight of 334.38 g/mol. Its IUPAC name is 5-(benzylamino)-N-(2-methoxyphenyl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-(benzylamino)-N-(2-methoxyphenyl)pyrazine-2-carboxamide
PubChem CID109279891
Molecular FormulaC19H18N4O2
Molecular Weight334.38 g/mol
Exact Mass334.14
IUPAC Name5-(benzylamino)-N-(2-methoxyphenyl)pyrazine-2-carboxamide
SMILESCOc1ccccc1NC(=O)c1cnc(NCc2ccccc2)cn1
InChIInChI=1S/C19H18N4O2/c1-25-17-10-6-5-9-15(17)23-19(24)16-12-22-18(13-20-16)21-11-14-7-3-2-4-8-14/h2-10,12-13H,11H2,1H3,(H,21,22)(H,23,24)
InChIKeyMKDKZBFFESHUNS-UHFFFAOYSA-N
XLogP3.35
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.38
LogP ≤ 53.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-(benzylamino)-N-(2-methoxy-5-methylphenyl)pyrazine-2-carboxamide
CID 109279896
5-(2-methoxyethylamino)-N-(2-methoxyphenyl)pyrazine-2-carboxamide
CID 109275954
N-(2-ethoxyphenyl)-5-[(4-fluorophenyl)methylamino]pyrazine-2-carboxamide
CID 109281748
5-(tert-butylamino)-N-(2-methoxyphenyl)pyrazine-2-carboxamide
CID 109287391
N-benzyl-5-(2-methoxyanilino)pyrazine-2-carboxamide
CID 109279734
N-(2-chlorophenyl)-5-[(2-methoxyphenyl)methylamino]pyrazine-2-carboxamide
CID 109282336
N-(2-fluorophenyl)-5-[(4-methoxyphenyl)methylamino]pyrazine-2-carboxamide
CID 109282537
5-(benzylamino)-N-[2-(trifluoromethyl)phenyl]pyrazine-2-carboxamide
CID 109279902
N-(2,4-dimethoxyphenyl)-5-(pyridin-3-ylmethylamino)pyrazine-2-carboxamide
CID 109283445
N-(2-methoxyphenyl)-5-(pyridin-3-ylmethylamino)pyridine-2-carboxamide
CID 109191392
5-(benzylamino)-N-(2,6-dimethylphenyl)pyrazine-2-carboxamide
CID 109279863
N-benzyl-5-(benzylamino)pyrazine-2-carboxamide
CID 109279637

Frequently Asked Questions

What is the IUPAC name of 5-(benzylamino)-N-(2-methoxyphenyl)pyrazine-2-carboxamide?
The IUPAC name of 5-(benzylamino)-N-(2-methoxyphenyl)pyrazine-2-carboxamide (CID 109279891) is 5-(benzylamino)-N-(2-methoxyphenyl)pyrazine-2-carboxamide.
What is the SMILES notation for 5-(benzylamino)-N-(2-methoxyphenyl)pyrazine-2-carboxamide?
The canonical SMILES for 5-(benzylamino)-N-(2-methoxyphenyl)pyrazine-2-carboxamide is COc1ccccc1NC(=O)c1cnc(NCc2ccccc2)cn1.
What is the InChIKey of 5-(benzylamino)-N-(2-methoxyphenyl)pyrazine-2-carboxamide?
The InChIKey is MKDKZBFFESHUNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O2/c1-25-17-10-6-5-9-15(17)23-19(24)16-12-22-18(13-20-16)21-11-14-7-3-2-4-8-14/h2-10,12-13H,11H2,1H3,(H,21,22)(H,23,24).
What are the key properties of 5-(benzylamino)-N-(2-methoxyphenyl)pyrazine-2-carboxamide?
5-(benzylamino)-N-(2-methoxyphenyl)pyrazine-2-carboxamide has a molecular weight of 334.38 g/mol, XLogP of 3.35, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(benzylamino)-N-(2-methoxyphenyl)pyrazine-2-carboxamide is sourced from PubChem (CID 109279891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).