N-[(1,5-dimethylpyrazol-3-yl)methyl]-3,4-dimethylbenzamide

C15H19N3O — CID 19329054

IUPACN-[(1,5-dimethylpyrazol-3-yl)methyl]-3,4-dimethylbenzamide
SMILESCc1ccc(C(=O)NCc2cc(C)n(C)n2)cc1C
InChIInChI=1S/C15H19N3O/c1-10-5-6-13(7-11(10)2)15(19)16-9-14-8-12(3)18(4)17-14/h5-8H,9H2,1-4H3,(H,16,19)
InChIKeyZIKSSOUIZFGDGM-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.28
Rot. Bonds3

About N-[(1,5-dimethylpyrazol-3-yl)methyl]-3,4-dimethylbenzamide

N-[(1,5-dimethylpyrazol-3-yl)methyl]-3,4-dimethylbenzamide (PubChem CID 19329054) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is N-[(1,5-dimethylpyrazol-3-yl)methyl]-3,4-dimethylbenzamide.

Molecular Properties

Compound NameN-[(1,5-dimethylpyrazol-3-yl)methyl]-3,4-dimethylbenzamide
PubChem CID19329054
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC NameN-[(1,5-dimethylpyrazol-3-yl)methyl]-3,4-dimethylbenzamide
SMILESCc1ccc(C(=O)NCc2cc(C)n(C)n2)cc1C
InChIInChI=1S/C15H19N3O/c1-10-5-6-13(7-11(10)2)15(19)16-9-14-8-12(3)18(4)17-14/h5-8H,9H2,1-4H3,(H,16,19)
InChIKeyZIKSSOUIZFGDGM-UHFFFAOYSA-N
XLogP2.28
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[(1,5-dimethylpyrazol-3-yl)methyl]-3,4-dimethylbenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3,4-dimethyl-N-[(1-methylpyrazol-3-yl)methyl]benzamide
CID 19330914
N-[(1,5-dimethylpyrazol-3-yl)methyl]-2,4-dimethylbenzamide
CID 19329057
4-chloro-N-[(1,5-dimethylpyrazol-3-yl)methyl]-3-nitrobenzamide
CID 19329136
3,4-dimethyl-N-[(2-methyl-1,3-oxazol-4-yl)methyl]benzamide
CID 110714591
N-[(1,5-dimethylpyrazol-3-yl)methyl]-3-(2,2,2-trifluoroethoxy)benzamide
CID 19329009
N-[(1,5-dimethylpyrazol-3-yl)methyl]-2,4-dimethoxybenzamide
CID 19329060
4-methyl-N-[(1-methylpyrazol-3-yl)methyl]-3-nitrobenzamide
CID 19329175
N-[(1,5-dimethylpyrazol-3-yl)methyl]-2-(3-phenylpropyl)-1,3-benzoxazole-5-carboxamide
CID 42526152
N-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-3,4-dimethylbenzamide
CID 110739109
3,4-dimethyl-N-(1H-pyrrol-3-ylmethyl)benzamide
CID 110782670
4-hydroxy-3-methyl-N-[(1-methyl-1,2,4-triazol-3-yl)methyl]benzamide
CID 113358719
3,4-dimethyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]benzamide
CID 110318313

Frequently Asked Questions

What is the IUPAC name of N-[(1,5-dimethylpyrazol-3-yl)methyl]-3,4-dimethylbenzamide?
The IUPAC name of N-[(1,5-dimethylpyrazol-3-yl)methyl]-3,4-dimethylbenzamide (CID 19329054) is N-[(1,5-dimethylpyrazol-3-yl)methyl]-3,4-dimethylbenzamide.
What is the SMILES notation for N-[(1,5-dimethylpyrazol-3-yl)methyl]-3,4-dimethylbenzamide?
The canonical SMILES for N-[(1,5-dimethylpyrazol-3-yl)methyl]-3,4-dimethylbenzamide is Cc1ccc(C(=O)NCc2cc(C)n(C)n2)cc1C.
What is the InChIKey of N-[(1,5-dimethylpyrazol-3-yl)methyl]-3,4-dimethylbenzamide?
The InChIKey is ZIKSSOUIZFGDGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-10-5-6-13(7-11(10)2)15(19)16-9-14-8-12(3)18(4)17-14/h5-8H,9H2,1-4H3,(H,16,19).
What are the key properties of N-[(1,5-dimethylpyrazol-3-yl)methyl]-3,4-dimethylbenzamide?
N-[(1,5-dimethylpyrazol-3-yl)methyl]-3,4-dimethylbenzamide has a molecular weight of 257.34 g/mol, XLogP of 2.28, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1,5-dimethylpyrazol-3-yl)methyl]-3,4-dimethylbenzamide is sourced from PubChem (CID 19329054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).