4-(4,5-dimethyl-1,3-thiazol-2-yl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazine-1-carboxamide

C15H21N5O2S — CID 75388415

IUPAC4-(4,5-dimethyl-1,3-thiazol-2-yl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazine-1-carboxamide
SMILESCc1cc(CNC(=O)N2CCN(c3nc(C)c(C)s3)CC2)no1
InChIInChI=1S/C15H21N5O2S/c1-10-8-13(18-22-10)9-16-14(21)19-4-6-20(7-5-19)15-17-11(2)12(3)23-15/h8H,4-7,9H2,1-3H3,(H,16,21)
InChIKeyZMAWPUGTSIUQBD-UHFFFAOYSA-N
MW335.43 g/mol
LogP2.09
Rot. Bonds3

About 4-(4,5-dimethyl-1,3-thiazol-2-yl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazine-1-carboxamide

4-(4,5-dimethyl-1,3-thiazol-2-yl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazine-1-carboxamide (PubChem CID 75388415) has the molecular formula C15H21N5O2S and a molecular weight of 335.43 g/mol. Its IUPAC name is 4-(4,5-dimethyl-1,3-thiazol-2-yl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazine-1-carboxamide.

Molecular Properties

Compound Name4-(4,5-dimethyl-1,3-thiazol-2-yl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazine-1-carboxamide
PubChem CID75388415
Molecular FormulaC15H21N5O2S
Molecular Weight335.43 g/mol
Exact Mass335.14
IUPAC Name4-(4,5-dimethyl-1,3-thiazol-2-yl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazine-1-carboxamide
SMILESCc1cc(CNC(=O)N2CCN(c3nc(C)c(C)s3)CC2)no1
InChIInChI=1S/C15H21N5O2S/c1-10-8-13(18-22-10)9-16-14(21)19-4-6-20(7-5-19)15-17-11(2)12(3)23-15/h8H,4-7,9H2,1-3H3,(H,16,21)
InChIKeyZMAWPUGTSIUQBD-UHFFFAOYSA-N
XLogP2.09
TPSA74.50 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.43
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-(4,5-dimethyl-1,3-thiazol-2-yl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazine-1-carboxamide 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 4-(4,5-dimethyl-1,3-thiazol-2-yl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazine-1-carboxamide?
The IUPAC name of 4-(4,5-dimethyl-1,3-thiazol-2-yl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazine-1-carboxamide (CID 75388415) is 4-(4,5-dimethyl-1,3-thiazol-2-yl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazine-1-carboxamide.
What is the SMILES notation for 4-(4,5-dimethyl-1,3-thiazol-2-yl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazine-1-carboxamide?
The canonical SMILES for 4-(4,5-dimethyl-1,3-thiazol-2-yl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazine-1-carboxamide is Cc1cc(CNC(=O)N2CCN(c3nc(C)c(C)s3)CC2)no1.
What is the InChIKey of 4-(4,5-dimethyl-1,3-thiazol-2-yl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazine-1-carboxamide?
The InChIKey is ZMAWPUGTSIUQBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5O2S/c1-10-8-13(18-22-10)9-16-14(21)19-4-6-20(7-5-19)15-17-11(2)12(3)23-15/h8H,4-7,9H2,1-3H3,(H,16,21).
What are the key properties of 4-(4,5-dimethyl-1,3-thiazol-2-yl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazine-1-carboxamide?
4-(4,5-dimethyl-1,3-thiazol-2-yl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazine-1-carboxamide has a molecular weight of 335.43 g/mol, XLogP of 2.09, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4,5-dimethyl-1,3-thiazol-2-yl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazine-1-carboxamide is sourced from PubChem (CID 75388415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).