2-(4-amino-3,5-dimethylpyrazol-1-yl)-N-methyl-N-[(2-methylphenyl)methyl]acetamide

C16H22N4O — CID 43574064

IUPAC2-(4-amino-3,5-dimethylpyrazol-1-yl)-N-methyl-N-[(2-methylphenyl)methyl]acetamide
SMILESCc1ccccc1CN(C)C(=O)Cn1nc(C)c(N)c1C
InChIInChI=1S/C16H22N4O/c1-11-7-5-6-8-14(11)9-19(4)15(21)10-20-13(3)16(17)12(2)18-20/h5-8H,9-10,17H2,1-4H3
InChIKeyARMDKELSCIGUDB-UHFFFAOYSA-N
MW286.38 g/mol
LogP2.05
Rot. Bonds4

About 2-(4-amino-3,5-dimethylpyrazol-1-yl)-N-methyl-N-[(2-methylphenyl)methyl]acetamide

2-(4-amino-3,5-dimethylpyrazol-1-yl)-N-methyl-N-[(2-methylphenyl)methyl]acetamide (PubChem CID 43574064) has the molecular formula C16H22N4O and a molecular weight of 286.38 g/mol. Its IUPAC name is 2-(4-amino-3,5-dimethylpyrazol-1-yl)-N-methyl-N-[(2-methylphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-(4-amino-3,5-dimethylpyrazol-1-yl)-N-methyl-N-[(2-methylphenyl)methyl]acetamide
PubChem CID43574064
Molecular FormulaC16H22N4O
Molecular Weight286.38 g/mol
Exact Mass286.18
IUPAC Name2-(4-amino-3,5-dimethylpyrazol-1-yl)-N-methyl-N-[(2-methylphenyl)methyl]acetamide
SMILESCc1ccccc1CN(C)C(=O)Cn1nc(C)c(N)c1C
InChIInChI=1S/C16H22N4O/c1-11-7-5-6-8-14(11)9-19(4)15(21)10-20-13(3)16(17)12(2)18-20/h5-8H,9-10,17H2,1-4H3
InChIKeyARMDKELSCIGUDB-UHFFFAOYSA-N
XLogP2.05
TPSA64.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(4-amino-3,5-dimethylpyrazol-1-yl)-N-methyl-N-[(2-methylphenyl)methyl]acetamide 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

2-[4-[ethyl(methyl)sulfamoyl]-3,5-dimethylpyrazol-1-yl]-N-methyl-N-[(2-methylphenyl)methyl]acetamide
CID 60548087
2-(4-amino-3,5-dimethylpyrazol-1-yl)-N-[2-(2-methylphenyl)ethyl]acetamide
CID 79756144
2-(4-amino-3,5-dimethylpyrazol-1-yl)-N-methyl-N-pyridin-4-ylacetamide
CID 106934214
2-hydroxy-N-methyl-N-[(2-methylphenyl)methyl]acetamide
CID 16769161
2-(4-amino-3,5-dimethylpyrazol-1-yl)-N-[(2-chlorophenyl)methyl]acetamide
CID 43445326
2-(4-aminopiperidin-1-yl)-N-methyl-N-[(2-methylphenyl)methyl]acetamide
CID 43556426
4-amino-N,3,3-trimethyl-N-[(2-methylphenyl)methyl]butanamide
CID 115157383
3-[methyl-[(2-methylphenyl)methyl]amino]-3-oxopropanoic acid
CID 62231590
2-[(3aR,6aS)-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl]-N-methyl-N-[(2-methylphenyl)methyl]acetamide;hydrochloride
CID 120663847
N-methyl-N-[(2-methylphenyl)methyl]-2-(4-methylsulfonylpiperazin-1-yl)acetamide
CID 27129035
2-(4-amino-3,5-dimethylpyrazol-1-yl)-N-ethyl-N-(3-methylphenyl)acetamide
CID 61075325
4-amino-1-ethyl-N-methyl-N-[(2-methylphenyl)methyl]pyrazole-5-carboxamide
CID 65357533

Frequently Asked Questions

What is the IUPAC name of 2-(4-amino-3,5-dimethylpyrazol-1-yl)-N-methyl-N-[(2-methylphenyl)methyl]acetamide?
The IUPAC name of 2-(4-amino-3,5-dimethylpyrazol-1-yl)-N-methyl-N-[(2-methylphenyl)methyl]acetamide (CID 43574064) is 2-(4-amino-3,5-dimethylpyrazol-1-yl)-N-methyl-N-[(2-methylphenyl)methyl]acetamide.
What is the SMILES notation for 2-(4-amino-3,5-dimethylpyrazol-1-yl)-N-methyl-N-[(2-methylphenyl)methyl]acetamide?
The canonical SMILES for 2-(4-amino-3,5-dimethylpyrazol-1-yl)-N-methyl-N-[(2-methylphenyl)methyl]acetamide is Cc1ccccc1CN(C)C(=O)Cn1nc(C)c(N)c1C.
What is the InChIKey of 2-(4-amino-3,5-dimethylpyrazol-1-yl)-N-methyl-N-[(2-methylphenyl)methyl]acetamide?
The InChIKey is ARMDKELSCIGUDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4O/c1-11-7-5-6-8-14(11)9-19(4)15(21)10-20-13(3)16(17)12(2)18-20/h5-8H,9-10,17H2,1-4H3.
What are the key properties of 2-(4-amino-3,5-dimethylpyrazol-1-yl)-N-methyl-N-[(2-methylphenyl)methyl]acetamide?
2-(4-amino-3,5-dimethylpyrazol-1-yl)-N-methyl-N-[(2-methylphenyl)methyl]acetamide has a molecular weight of 286.38 g/mol, XLogP of 2.05, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-amino-3,5-dimethylpyrazol-1-yl)-N-methyl-N-[(2-methylphenyl)methyl]acetamide is sourced from PubChem (CID 43574064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).