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

C16H23N5O2S — CID 75373713

IUPAC2-(3,5-dimethylpyrazol-1-yl)-N-[(4-methylmorpholin-2-yl)methyl]-N-(1,3-thiazol-2-yl)acetamide
SMILESCc1cc(C)n(CC(=O)N(CC2CN(C)CCO2)c2nccs2)n1
InChIInChI=1S/C16H23N5O2S/c1-12-8-13(2)21(18-12)11-15(22)20(16-17-4-7-24-16)10-14-9-19(3)5-6-23-14/h4,7-8,14H,5-6,9-11H2,1-3H3
InChIKeyIGANUNMPALGNEX-UHFFFAOYSA-N
MW349.46 g/mol
LogP1.32
Rot. Bonds5

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

2-(3,5-dimethylpyrazol-1-yl)-N-[(4-methylmorpholin-2-yl)methyl]-N-(1,3-thiazol-2-yl)acetamide (PubChem CID 75373713) has the molecular formula C16H23N5O2S and a molecular weight of 349.46 g/mol. Its IUPAC name is 2-(3,5-dimethylpyrazol-1-yl)-N-[(4-methylmorpholin-2-yl)methyl]-N-(1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-(3,5-dimethylpyrazol-1-yl)-N-[(4-methylmorpholin-2-yl)methyl]-N-(1,3-thiazol-2-yl)acetamide
PubChem CID75373713
Molecular FormulaC16H23N5O2S
Molecular Weight349.46 g/mol
Exact Mass349.16
IUPAC Name2-(3,5-dimethylpyrazol-1-yl)-N-[(4-methylmorpholin-2-yl)methyl]-N-(1,3-thiazol-2-yl)acetamide
SMILESCc1cc(C)n(CC(=O)N(CC2CN(C)CCO2)c2nccs2)n1
InChIInChI=1S/C16H23N5O2S/c1-12-8-13(2)21(18-12)11-15(22)20(16-17-4-7-24-16)10-14-9-19(3)5-6-23-14/h4,7-8,14H,5-6,9-11H2,1-3H3
InChIKeyIGANUNMPALGNEX-UHFFFAOYSA-N
XLogP1.32
TPSA63.49 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.46
LogP ≤ 51.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 2-(3,5-dimethylpyrazol-1-yl)-N-[(4-methylmorpholin-2-yl)methyl]-N-(1,3-thiazol-2-yl)acetamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethylpyrazol-1-yl)-N-[(4-methylmorpholin-2-yl)methyl]-N-(1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-(3,5-dimethylpyrazol-1-yl)-N-[(4-methylmorpholin-2-yl)methyl]-N-(1,3-thiazol-2-yl)acetamide (CID 75373713) is 2-(3,5-dimethylpyrazol-1-yl)-N-[(4-methylmorpholin-2-yl)methyl]-N-(1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-(3,5-dimethylpyrazol-1-yl)-N-[(4-methylmorpholin-2-yl)methyl]-N-(1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-(3,5-dimethylpyrazol-1-yl)-N-[(4-methylmorpholin-2-yl)methyl]-N-(1,3-thiazol-2-yl)acetamide is Cc1cc(C)n(CC(=O)N(CC2CN(C)CCO2)c2nccs2)n1.
What is the InChIKey of 2-(3,5-dimethylpyrazol-1-yl)-N-[(4-methylmorpholin-2-yl)methyl]-N-(1,3-thiazol-2-yl)acetamide?
The InChIKey is IGANUNMPALGNEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N5O2S/c1-12-8-13(2)21(18-12)11-15(22)20(16-17-4-7-24-16)10-14-9-19(3)5-6-23-14/h4,7-8,14H,5-6,9-11H2,1-3H3.
What are the key properties of 2-(3,5-dimethylpyrazol-1-yl)-N-[(4-methylmorpholin-2-yl)methyl]-N-(1,3-thiazol-2-yl)acetamide?
2-(3,5-dimethylpyrazol-1-yl)-N-[(4-methylmorpholin-2-yl)methyl]-N-(1,3-thiazol-2-yl)acetamide has a molecular weight of 349.46 g/mol, XLogP of 1.32, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethylpyrazol-1-yl)-N-[(4-methylmorpholin-2-yl)methyl]-N-(1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 75373713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).