N-(2,5-dimethylpyrazol-3-yl)-5-methyl-2-(methylamino)benzamide

C14H18N4O — CID 55083084

IUPACN-(2,5-dimethylpyrazol-3-yl)-5-methyl-2-(methylamino)benzamide
SMILESCNc1ccc(C)cc1C(=O)Nc1cc(C)nn1C
InChIInChI=1S/C14H18N4O/c1-9-5-6-12(15-3)11(7-9)14(19)16-13-8-10(2)17-18(13)4/h5-8,15H,1-4H3,(H,16,19)
InChIKeyLBJSONRGUBGBRC-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.33
Rot. Bonds3

About N-(2,5-dimethylpyrazol-3-yl)-5-methyl-2-(methylamino)benzamide

N-(2,5-dimethylpyrazol-3-yl)-5-methyl-2-(methylamino)benzamide (PubChem CID 55083084) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is N-(2,5-dimethylpyrazol-3-yl)-5-methyl-2-(methylamino)benzamide.

Molecular Properties

Compound NameN-(2,5-dimethylpyrazol-3-yl)-5-methyl-2-(methylamino)benzamide
PubChem CID55083084
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC NameN-(2,5-dimethylpyrazol-3-yl)-5-methyl-2-(methylamino)benzamide
SMILESCNc1ccc(C)cc1C(=O)Nc1cc(C)nn1C
InChIInChI=1S/C14H18N4O/c1-9-5-6-12(15-3)11(7-9)14(19)16-13-8-10(2)17-18(13)4/h5-8,15H,1-4H3,(H,16,19)
InChIKeyLBJSONRGUBGBRC-UHFFFAOYSA-N
XLogP2.33
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-bromo-N-(2,5-dimethylpyrazol-3-yl)-5-methylbenzamide
CID 80974367
2-chloro-N-(2,5-dimethylpyrazol-3-yl)benzamide
CID 3741602
2,5-dichloro-N-(2,5-dimethylpyrazol-3-yl)benzamide
CID 45284555
N-(2,5-dimethylpyrazol-3-yl)-2,3-dihydroxybenzamide
CID 114343847
2-[(2,5-dimethylpyrazol-3-yl)carbamoyl]benzoate
CID 6930153
N-(2,5-dimethylpyrazol-3-yl)-2,3-difluorobenzamide
CID 62650484
5-methyl-2-(methylamino)-N-(2,4,5-trifluorophenyl)benzamide
CID 62809031
3-N,4-N-bis(2,5-dimethylpyrazol-3-yl)-1-methylpyrazole-3,4-dicarboxamide
CID 29097892
N-(4-bromo-2-methylphenyl)-5-methyl-2-(methylamino)benzamide
CID 62509130
N-(3-fluoro-5-methylphenyl)-5-methyl-2-(methylamino)benzamide
CID 79046553
N-(2,6-dichlorophenyl)-5-methyl-2-(methylamino)benzamide
CID 65499464
N-(3-bromo-5-methylphenyl)-5-methyl-2-(methylamino)benzamide
CID 107578496

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethylpyrazol-3-yl)-5-methyl-2-(methylamino)benzamide?
The IUPAC name of N-(2,5-dimethylpyrazol-3-yl)-5-methyl-2-(methylamino)benzamide (CID 55083084) is N-(2,5-dimethylpyrazol-3-yl)-5-methyl-2-(methylamino)benzamide.
What is the SMILES notation for N-(2,5-dimethylpyrazol-3-yl)-5-methyl-2-(methylamino)benzamide?
The canonical SMILES for N-(2,5-dimethylpyrazol-3-yl)-5-methyl-2-(methylamino)benzamide is CNc1ccc(C)cc1C(=O)Nc1cc(C)nn1C.
What is the InChIKey of N-(2,5-dimethylpyrazol-3-yl)-5-methyl-2-(methylamino)benzamide?
The InChIKey is LBJSONRGUBGBRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c1-9-5-6-12(15-3)11(7-9)14(19)16-13-8-10(2)17-18(13)4/h5-8,15H,1-4H3,(H,16,19).
What are the key properties of N-(2,5-dimethylpyrazol-3-yl)-5-methyl-2-(methylamino)benzamide?
N-(2,5-dimethylpyrazol-3-yl)-5-methyl-2-(methylamino)benzamide has a molecular weight of 258.32 g/mol, XLogP of 2.33, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethylpyrazol-3-yl)-5-methyl-2-(methylamino)benzamide is sourced from PubChem (CID 55083084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).