4-(dimethylamino)-N-(2-methylpyrazol-3-yl)benzamide

C13H16N4O — CID 110473266

IUPAC4-(dimethylamino)-N-(2-methylpyrazol-3-yl)benzamide
SMILESCN(C)c1ccc(C(=O)Nc2ccnn2C)cc1
InChIInChI=1S/C13H16N4O/c1-16(2)11-6-4-10(5-7-11)13(18)15-12-8-9-14-17(12)3/h4-9H,1-3H3,(H,15,18)
InChIKeySBRFKQODGVDRQZ-UHFFFAOYSA-N
MW244.30 g/mol
LogP1.74
Rot. Bonds3

About 4-(dimethylamino)-N-(2-methylpyrazol-3-yl)benzamide

4-(dimethylamino)-N-(2-methylpyrazol-3-yl)benzamide (PubChem CID 110473266) has the molecular formula C13H16N4O and a molecular weight of 244.30 g/mol. Its IUPAC name is 4-(dimethylamino)-N-(2-methylpyrazol-3-yl)benzamide.

Molecular Properties

Compound Name4-(dimethylamino)-N-(2-methylpyrazol-3-yl)benzamide
PubChem CID110473266
Molecular FormulaC13H16N4O
Molecular Weight244.30 g/mol
Exact Mass244.13
IUPAC Name4-(dimethylamino)-N-(2-methylpyrazol-3-yl)benzamide
SMILESCN(C)c1ccc(C(=O)Nc2ccnn2C)cc1
InChIInChI=1S/C13H16N4O/c1-16(2)11-6-4-10(5-7-11)13(18)15-12-8-9-14-17(12)3/h4-9H,1-3H3,(H,15,18)
InChIKeySBRFKQODGVDRQZ-UHFFFAOYSA-N
XLogP1.74
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.30
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methylpyrazol-3-yl)pyridine-4-carboxamide
CID 110471287
4-hydroxy-3-methyl-N-(2-methylpyrazol-3-yl)benzamide
CID 103956818
4-hydrazinyl-3-methyl-N-(2-methylpyrazol-3-yl)benzamide
CID 63211576
4-bromo-3-chloro-N-(2-methylpyrazol-3-yl)benzamide
CID 81005079
3-fluoro-N-(2-methylpyrazol-3-yl)benzamide
CID 110472464
N-[[4-(dimethylamino)phenyl]methyl]-2-methylpyrazole-3-carboxamide
CID 110467140
N-(2-methylpyrazol-3-yl)-1H-indazole-6-carboxamide
CID 62905623
2-methyl-N-(2-methylpyrazol-3-yl)benzamide
CID 66675219
N-(4-acetamidophenyl)-4-(dimethylamino)benzamide
CID 669679
3-methyl-N-(2-methylpyrazol-3-yl)-4-(propylamino)benzamide
CID 63214108
3-hydroxy-N-(2-methylpyrazol-3-yl)pyridine-4-carboxamide
CID 81443340
3-methyl-N-(2-methylpyrazol-3-yl)-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide
CID 112524831

Frequently Asked Questions

What is the IUPAC name of 4-(dimethylamino)-N-(2-methylpyrazol-3-yl)benzamide?
The IUPAC name of 4-(dimethylamino)-N-(2-methylpyrazol-3-yl)benzamide (CID 110473266) is 4-(dimethylamino)-N-(2-methylpyrazol-3-yl)benzamide.
What is the SMILES notation for 4-(dimethylamino)-N-(2-methylpyrazol-3-yl)benzamide?
The canonical SMILES for 4-(dimethylamino)-N-(2-methylpyrazol-3-yl)benzamide is CN(C)c1ccc(C(=O)Nc2ccnn2C)cc1.
What is the InChIKey of 4-(dimethylamino)-N-(2-methylpyrazol-3-yl)benzamide?
The InChIKey is SBRFKQODGVDRQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O/c1-16(2)11-6-4-10(5-7-11)13(18)15-12-8-9-14-17(12)3/h4-9H,1-3H3,(H,15,18).
What are the key properties of 4-(dimethylamino)-N-(2-methylpyrazol-3-yl)benzamide?
4-(dimethylamino)-N-(2-methylpyrazol-3-yl)benzamide has a molecular weight of 244.30 g/mol, XLogP of 1.74, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylamino)-N-(2-methylpyrazol-3-yl)benzamide is sourced from PubChem (CID 110473266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).