3-methyl-N-[(5-methylpyrazin-2-yl)methyl]benzamide

C14H15N3O — CID 23530641

IUPAC3-methyl-N-[(5-methylpyrazin-2-yl)methyl]benzamide
SMILESCc1cccc(C(=O)NCc2cnc(C)cn2)c1
InChIInChI=1S/C14H15N3O/c1-10-4-3-5-12(6-10)14(18)17-9-13-8-15-11(2)7-16-13/h3-8H,9H2,1-2H3,(H,17,18)
InChIKeyXODCMHPIJXNLTD-UHFFFAOYSA-N
MW241.29 g/mol
LogP2.02
Rot. Bonds3

About 3-methyl-N-[(5-methylpyrazin-2-yl)methyl]benzamide

3-methyl-N-[(5-methylpyrazin-2-yl)methyl]benzamide (PubChem CID 23530641) has the molecular formula C14H15N3O and a molecular weight of 241.29 g/mol. Its IUPAC name is 3-methyl-N-[(5-methylpyrazin-2-yl)methyl]benzamide.

Molecular Properties

Compound Name3-methyl-N-[(5-methylpyrazin-2-yl)methyl]benzamide
PubChem CID23530641
Molecular FormulaC14H15N3O
Molecular Weight241.29 g/mol
Exact Mass241.12
IUPAC Name3-methyl-N-[(5-methylpyrazin-2-yl)methyl]benzamide
SMILESCc1cccc(C(=O)NCc2cnc(C)cn2)c1
InChIInChI=1S/C14H15N3O/c1-10-4-3-5-12(6-10)14(18)17-9-13-8-15-11(2)7-16-13/h3-8H,9H2,1-2H3,(H,17,18)
InChIKeyXODCMHPIJXNLTD-UHFFFAOYSA-N
XLogP2.02
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(5-methylpyrazin-2-yl)methyl]-1H-indole-6-carboxamide
CID 63770378
3-(2-methoxyphenyl)-N-[(5-methylpyrazin-2-yl)methyl]benzamide
CID 50950516
3,5-dibromo-N-[(5-methylpyrazin-2-yl)methyl]benzamide
CID 114023576
2-hydroxy-3-methyl-N-[(5-methylpyrazin-2-yl)methyl]benzamide
CID 62848139
3-[[(2R)-1-hydroxybutan-2-yl]sulfamoyl]-N-[(5-methylpyrazin-2-yl)methyl]benzamide
CID 97281167
methyl 2-chloro-6-[3-[(5-methylpyrazin-2-yl)methylcarbamoyl]phenyl]benzoate
CID 91357324
3-amino-N-methyl-6-[3-[(5-methylpyrazin-2-yl)methylcarbamoyl]phenyl]pyrazine-2-carboxamide
CID 68651018
5,6-dichloro-N-[(5-methylpyrazin-2-yl)methyl]pyridine-3-carboxamide
CID 62847930
2-hydrazinyl-6-methyl-N-[(5-methylpyrazin-2-yl)methyl]pyridine-4-carboxamide
CID 113379230
N-[[4-(hydroxymethyl)phenyl]methyl]-3-methylbenzamide
CID 107231351
N-(furan-2-ylmethyl)-3-methylbenzamide
CID 796307
5-chloro-6-hydrazinyl-N-[(5-methylpyrazin-2-yl)methyl]pyridine-3-carboxamide
CID 62840708

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[(5-methylpyrazin-2-yl)methyl]benzamide?
The IUPAC name of 3-methyl-N-[(5-methylpyrazin-2-yl)methyl]benzamide (CID 23530641) is 3-methyl-N-[(5-methylpyrazin-2-yl)methyl]benzamide.
What is the SMILES notation for 3-methyl-N-[(5-methylpyrazin-2-yl)methyl]benzamide?
The canonical SMILES for 3-methyl-N-[(5-methylpyrazin-2-yl)methyl]benzamide is Cc1cccc(C(=O)NCc2cnc(C)cn2)c1.
What is the InChIKey of 3-methyl-N-[(5-methylpyrazin-2-yl)methyl]benzamide?
The InChIKey is XODCMHPIJXNLTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O/c1-10-4-3-5-12(6-10)14(18)17-9-13-8-15-11(2)7-16-13/h3-8H,9H2,1-2H3,(H,17,18).
What are the key properties of 3-methyl-N-[(5-methylpyrazin-2-yl)methyl]benzamide?
3-methyl-N-[(5-methylpyrazin-2-yl)methyl]benzamide has a molecular weight of 241.29 g/mol, XLogP of 2.02, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[(5-methylpyrazin-2-yl)methyl]benzamide is sourced from PubChem (CID 23530641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).