5-[(3-methylphenyl)methylamino]-N-(pyridin-3-ylmethyl)pyrazine-2-carboxamide

C19H19N5O — CID 109280368

IUPAC5-[(3-methylphenyl)methylamino]-N-(pyridin-3-ylmethyl)pyrazine-2-carboxamide
SMILESCc1cccc(CNc2cnc(C(=O)NCc3cccnc3)cn2)c1
InChIInChI=1S/C19H19N5O/c1-14-4-2-5-15(8-14)10-22-18-13-21-17(12-23-18)19(25)24-11-16-6-3-7-20-9-16/h2-9,12-13H,10-11H2,1H3,(H,22,23)(H,24,25)
InChIKeyRTZNWMVINPHURQ-UHFFFAOYSA-N
MW333.39 g/mol
LogP2.72
Rot. Bonds6

About 5-[(3-methylphenyl)methylamino]-N-(pyridin-3-ylmethyl)pyrazine-2-carboxamide

5-[(3-methylphenyl)methylamino]-N-(pyridin-3-ylmethyl)pyrazine-2-carboxamide (PubChem CID 109280368) has the molecular formula C19H19N5O and a molecular weight of 333.39 g/mol. Its IUPAC name is 5-[(3-methylphenyl)methylamino]-N-(pyridin-3-ylmethyl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-[(3-methylphenyl)methylamino]-N-(pyridin-3-ylmethyl)pyrazine-2-carboxamide
PubChem CID109280368
Molecular FormulaC19H19N5O
Molecular Weight333.39 g/mol
Exact Mass333.16
IUPAC Name5-[(3-methylphenyl)methylamino]-N-(pyridin-3-ylmethyl)pyrazine-2-carboxamide
SMILESCc1cccc(CNc2cnc(C(=O)NCc3cccnc3)cn2)c1
InChIInChI=1S/C19H19N5O/c1-14-4-2-5-15(8-14)10-22-18-13-21-17(12-23-18)19(25)24-11-16-6-3-7-20-9-16/h2-9,12-13H,10-11H2,1H3,(H,22,23)(H,24,25)
InChIKeyRTZNWMVINPHURQ-UHFFFAOYSA-N
XLogP2.72
TPSA79.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.39
LogP ≤ 52.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-methylphenyl)-5-(pyridin-3-ylmethylamino)pyrazine-2-carboxamide
CID 109283399
5-[(3-methylphenyl)methylamino]-N-pentylpyrazine-2-carboxamide
CID 109280397
4-N-[(3-methylphenyl)methyl]-2-N-(pyridin-3-ylmethyl)pyridine-2,4-dicarboxamide
CID 109085686
N'-[(3-methylphenyl)methyl]-N-(pyridin-3-ylmethyl)oxamide
CID 108984681
N-(2-chloro-4,6-dimethylphenyl)-5-(pyridin-3-ylmethylamino)pyrazine-2-carboxamide
CID 109283431
N-benzyl-5-(benzylamino)pyrazine-2-carboxamide
CID 109279637
N-(4-chlorophenyl)-5-[(3-methylphenyl)methylamino]pyrazine-2-carboxamide
CID 109280431
5-(3-acetamidoanilino)-N-(pyridin-3-ylmethyl)pyrazine-2-carboxamide
CID 109283309
N-[2-(4-methoxyphenoxy)ethyl]-5-[(3-methylphenyl)methylamino]pyrazine-2-carboxamide
CID 109280392
5-[2-(4-methoxyphenoxy)ethylamino]-N-[(3-methylphenyl)methyl]pyrazine-2-carboxamide
CID 109280259
N-(3-chlorophenyl)-5-(pyridin-3-ylmethylamino)pyrazine-2-carboxamide
CID 109283424
N-(2,3-dimethylphenyl)-5-[(3-methylphenyl)methylamino]pyrazine-2-carboxamide
CID 109280416

Frequently Asked Questions

What is the IUPAC name of 5-[(3-methylphenyl)methylamino]-N-(pyridin-3-ylmethyl)pyrazine-2-carboxamide?
The IUPAC name of 5-[(3-methylphenyl)methylamino]-N-(pyridin-3-ylmethyl)pyrazine-2-carboxamide (CID 109280368) is 5-[(3-methylphenyl)methylamino]-N-(pyridin-3-ylmethyl)pyrazine-2-carboxamide.
What is the SMILES notation for 5-[(3-methylphenyl)methylamino]-N-(pyridin-3-ylmethyl)pyrazine-2-carboxamide?
The canonical SMILES for 5-[(3-methylphenyl)methylamino]-N-(pyridin-3-ylmethyl)pyrazine-2-carboxamide is Cc1cccc(CNc2cnc(C(=O)NCc3cccnc3)cn2)c1.
What is the InChIKey of 5-[(3-methylphenyl)methylamino]-N-(pyridin-3-ylmethyl)pyrazine-2-carboxamide?
The InChIKey is RTZNWMVINPHURQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N5O/c1-14-4-2-5-15(8-14)10-22-18-13-21-17(12-23-18)19(25)24-11-16-6-3-7-20-9-16/h2-9,12-13H,10-11H2,1H3,(H,22,23)(H,24,25).
What are the key properties of 5-[(3-methylphenyl)methylamino]-N-(pyridin-3-ylmethyl)pyrazine-2-carboxamide?
5-[(3-methylphenyl)methylamino]-N-(pyridin-3-ylmethyl)pyrazine-2-carboxamide has a molecular weight of 333.39 g/mol, XLogP of 2.72, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(3-methylphenyl)methylamino]-N-(pyridin-3-ylmethyl)pyrazine-2-carboxamide is sourced from PubChem (CID 109280368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).