N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]pyrazine-2-carboxamide

C16H15N5O — CID 43036761

IUPACN-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]pyrazine-2-carboxamide
SMILESCc1ccc(-n2nc(C)cc2NC(=O)c2cnccn2)cc1
InChIInChI=1S/C16H15N5O/c1-11-3-5-13(6-4-11)21-15(9-12(2)20-21)19-16(22)14-10-17-7-8-18-14/h3-10H,1-2H3,(H,19,22)
InChIKeyDGVKPHSAKCMAJT-UHFFFAOYSA-N
MW293.33 g/mol
LogP2.53
Rot. Bonds3

About N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]pyrazine-2-carboxamide

N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]pyrazine-2-carboxamide (PubChem CID 43036761) has the molecular formula C16H15N5O and a molecular weight of 293.33 g/mol. Its IUPAC name is N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]pyrazine-2-carboxamide
PubChem CID43036761
Molecular FormulaC16H15N5O
Molecular Weight293.33 g/mol
Exact Mass293.13
IUPAC NameN-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]pyrazine-2-carboxamide
SMILESCc1ccc(-n2nc(C)cc2NC(=O)c2cnccn2)cc1
InChIInChI=1S/C16H15N5O/c1-11-3-5-13(6-4-11)21-15(9-12(2)20-21)19-16(22)14-10-17-7-8-18-14/h3-10H,1-2H3,(H,19,22)
InChIKeyDGVKPHSAKCMAJT-UHFFFAOYSA-N
XLogP2.53
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.33
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]pyridine-4-carboxamide
CID 71943772
5-bromo-2-chloro-N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]benzamide
CID 43018546
4-methoxy-N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]benzamide
CID 2352142
N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]-4-phenoxybenzamide
CID 3372740
3-chloro-4,5-dimethoxy-N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]benzamide
CID 43036788
N-(2,5-dimethylphenyl)pyrazine-2-carboxamide
CID 803312
2-[[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]amino]-N-pyridin-3-ylbenzamide
CID 69277803
N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]-2-(trifluoromethyl)benzamide
CID 75524900
[2-[[3-(4-methylphenyl)-1-phenylpyrazol-5-yl]amino]-2-oxoethyl] pyrazine-2-carboxylate
CID 7985543
2-chloro-4-methyl-N-(5-methyl-2-phenylpyrazol-3-yl)benzamide
CID 139009806
N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]-3-(trifluoromethyl)benzamide
CID 43018526
3-methyl-N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]-4-nitrobenzamide
CID 43018544

Frequently Asked Questions

What is the IUPAC name of N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]pyrazine-2-carboxamide?
The IUPAC name of N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]pyrazine-2-carboxamide (CID 43036761) is N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]pyrazine-2-carboxamide.
What is the SMILES notation for N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]pyrazine-2-carboxamide?
The canonical SMILES for N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]pyrazine-2-carboxamide is Cc1ccc(-n2nc(C)cc2NC(=O)c2cnccn2)cc1.
What is the InChIKey of N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]pyrazine-2-carboxamide?
The InChIKey is DGVKPHSAKCMAJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N5O/c1-11-3-5-13(6-4-11)21-15(9-12(2)20-21)19-16(22)14-10-17-7-8-18-14/h3-10H,1-2H3,(H,19,22).
What are the key properties of N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]pyrazine-2-carboxamide?
N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]pyrazine-2-carboxamide has a molecular weight of 293.33 g/mol, XLogP of 2.53, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]pyrazine-2-carboxamide is sourced from PubChem (CID 43036761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).