4-(1-ethyl-3-methylpyrazol-4-yl)-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]benzamide

C19H22N4OS — CID 122572013

IUPAC4-(1-ethyl-3-methylpyrazol-4-yl)-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]benzamide
SMILESCCn1cc(-c2ccc(C(=O)NC(C)c3csc(C)n3)cc2)c(C)n1
InChIInChI=1S/C19H22N4OS/c1-5-23-10-17(12(2)22-23)15-6-8-16(9-7-15)19(24)20-13(3)18-11-25-14(4)21-18/h6-11,13H,5H2,1-4H3,(H,20,24)
InChIKeyUGMKXBXTRXLRPU-UHFFFAOYSA-N
MW354.48 g/mol
LogP4.13
Rot. Bonds5

About 4-(1-ethyl-3-methylpyrazol-4-yl)-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]benzamide

4-(1-ethyl-3-methylpyrazol-4-yl)-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]benzamide (PubChem CID 122572013) has the molecular formula C19H22N4OS and a molecular weight of 354.48 g/mol. Its IUPAC name is 4-(1-ethyl-3-methylpyrazol-4-yl)-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]benzamide.

Molecular Properties

Compound Name4-(1-ethyl-3-methylpyrazol-4-yl)-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]benzamide
PubChem CID122572013
Molecular FormulaC19H22N4OS
Molecular Weight354.48 g/mol
Exact Mass354.15
IUPAC Name4-(1-ethyl-3-methylpyrazol-4-yl)-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]benzamide
SMILESCCn1cc(-c2ccc(C(=O)NC(C)c3csc(C)n3)cc2)c(C)n1
InChIInChI=1S/C19H22N4OS/c1-5-23-10-17(12(2)22-23)15-6-8-16(9-7-15)19(24)20-13(3)18-11-25-14(4)21-18/h6-11,13H,5H2,1-4H3,(H,20,24)
InChIKeyUGMKXBXTRXLRPU-UHFFFAOYSA-N
XLogP4.13
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.48
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-(1-ethyl-3-methylpyrazol-4-yl)-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]benzamide 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

4-chloro-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]benzamide
CID 108760051
4-(3-hydroxy-3-methylbutyl)-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]benzamide
CID 56894427
2-ethyl-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]pyridine-4-carboxamide
CID 90650191
3,4-dimethoxy-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]benzamide
CID 108760036
1-ethyl-N-[1-(1-ethylpyrazol-3-yl)ethyl]-3-methylpyrazole-4-carboxamide
CID 19474462
3-ethoxy-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]benzamide
CID 108737233
1-ethyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]pyrazole-4-carboxamide
CID 45179322
4-(dimethylamino)-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]-3-nitrobenzamide
CID 108737167
4-[5-(4-fluorophenyl)tetrazol-2-yl]-N-[(1S)-1-(2-methyl-1,3-thiazol-4-yl)ethyl]butanamide
CID 99972025
N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]-2H-triazole-4-carboxamide
CID 136524359
N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]-4-oxo-4-phenylbutanamide
CID 108737245
N-[[4-(1-ethyl-3-methylpyrazol-4-yl)phenyl]methyl]ethanamine
CID 66020203

Frequently Asked Questions

What is the IUPAC name of 4-(1-ethyl-3-methylpyrazol-4-yl)-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]benzamide?
The IUPAC name of 4-(1-ethyl-3-methylpyrazol-4-yl)-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]benzamide (CID 122572013) is 4-(1-ethyl-3-methylpyrazol-4-yl)-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]benzamide.
What is the SMILES notation for 4-(1-ethyl-3-methylpyrazol-4-yl)-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]benzamide?
The canonical SMILES for 4-(1-ethyl-3-methylpyrazol-4-yl)-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]benzamide is CCn1cc(-c2ccc(C(=O)NC(C)c3csc(C)n3)cc2)c(C)n1.
What is the InChIKey of 4-(1-ethyl-3-methylpyrazol-4-yl)-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]benzamide?
The InChIKey is UGMKXBXTRXLRPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4OS/c1-5-23-10-17(12(2)22-23)15-6-8-16(9-7-15)19(24)20-13(3)18-11-25-14(4)21-18/h6-11,13H,5H2,1-4H3,(H,20,24).
What are the key properties of 4-(1-ethyl-3-methylpyrazol-4-yl)-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]benzamide?
4-(1-ethyl-3-methylpyrazol-4-yl)-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]benzamide has a molecular weight of 354.48 g/mol, XLogP of 4.13, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-ethyl-3-methylpyrazol-4-yl)-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]benzamide is sourced from PubChem (CID 122572013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).