3-(5-chloro-3-methyl-1,2-oxazol-4-yl)-N-[2-(2-methylphenyl)pyrazol-3-yl]propanamide

C17H17ClN4O2 — CID 126787813

IUPAC3-(5-chloro-3-methyl-1,2-oxazol-4-yl)-N-[2-(2-methylphenyl)pyrazol-3-yl]propanamide
SMILESCc1ccccc1-n1nccc1NC(=O)CCc1c(C)noc1Cl
InChIInChI=1S/C17H17ClN4O2/c1-11-5-3-4-6-14(11)22-15(9-10-19-22)20-16(23)8-7-13-12(2)21-24-17(13)18/h3-6,9-10H,7-8H2,1-2H3,(H,20,23)
InChIKeyTYDDESHPGQFIGB-UHFFFAOYSA-N
MW344.80 g/mol
LogP3.70
Rot. Bonds5

About 3-(5-chloro-3-methyl-1,2-oxazol-4-yl)-N-[2-(2-methylphenyl)pyrazol-3-yl]propanamide

3-(5-chloro-3-methyl-1,2-oxazol-4-yl)-N-[2-(2-methylphenyl)pyrazol-3-yl]propanamide (PubChem CID 126787813) has the molecular formula C17H17ClN4O2 and a molecular weight of 344.80 g/mol. Its IUPAC name is 3-(5-chloro-3-methyl-1,2-oxazol-4-yl)-N-[2-(2-methylphenyl)pyrazol-3-yl]propanamide.

Molecular Properties

Compound Name3-(5-chloro-3-methyl-1,2-oxazol-4-yl)-N-[2-(2-methylphenyl)pyrazol-3-yl]propanamide
PubChem CID126787813
Molecular FormulaC17H17ClN4O2
Molecular Weight344.80 g/mol
Exact Mass344.10
IUPAC Name3-(5-chloro-3-methyl-1,2-oxazol-4-yl)-N-[2-(2-methylphenyl)pyrazol-3-yl]propanamide
SMILESCc1ccccc1-n1nccc1NC(=O)CCc1c(C)noc1Cl
InChIInChI=1S/C17H17ClN4O2/c1-11-5-3-4-6-14(11)22-15(9-10-19-22)20-16(23)8-7-13-12(2)21-24-17(13)18/h3-6,9-10H,7-8H2,1-2H3,(H,20,23)
InChIKeyTYDDESHPGQFIGB-UHFFFAOYSA-N
XLogP3.70
TPSA72.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.80
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-(5-chloro-3-methyl-1,2-oxazol-4-yl)-N-[2-(2-methylphenyl)pyrazol-3-yl]propanamide 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-(5-chloro-3-methyl-1,2-oxazol-4-yl)-N-[2-(ethylaminomethyl)phenyl]propanamide;hydrochloride
CID 119438931
2-(2,4-difluorophenyl)-N-[2-(2-methylphenyl)pyrazol-3-yl]acetamide
CID 97051340
1-(3-hydroxybutyl)-3-[2-(2-methylphenyl)pyrazol-3-yl]urea
CID 84598091
2-ethoxy-N-[2-(2-methylphenyl)pyrazol-3-yl]propanamide
CID 56789802
3-(5-chloro-3-methyl-1,2-oxazol-4-yl)-N-[(2R)-1-(2-methylphenoxy)propan-2-yl]propanamide
CID 95165188
(2R)-N-[2-(2-methylphenyl)pyrazol-3-yl]-2-methylsulfanylpropanamide
CID 96539727
3-(5-chloro-3-methyl-1,2-oxazol-4-yl)-N-[(2R)-1,1-diphenylpropan-2-yl]propanamide
CID 52909110
N-(2,6-dichlorophenyl)-3-(3,5-dimethyl-1,2-oxazol-4-yl)propanamide
CID 110651196
3-(5-chloro-3-methyl-1,2-oxazol-4-yl)-N-[4-[(2-methylpropan-2-yl)oxy]-3-pyridinyl]propanamide
CID 122159496
3-(5-chloro-3-methyl-1,2-oxazol-4-yl)-N-(1-cyclopentyl-5-methylpyrazol-4-yl)propanamide
CID 136536828
3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[2-(1,2,4-triazol-1-yl)phenyl]propanamide
CID 35371590
N-[2-[[2-(2-methylphenyl)pyrazol-3-yl]carbamoylamino]ethyl]cyclopropanecarboxamide
CID 84598089

Frequently Asked Questions

What is the IUPAC name of 3-(5-chloro-3-methyl-1,2-oxazol-4-yl)-N-[2-(2-methylphenyl)pyrazol-3-yl]propanamide?
The IUPAC name of 3-(5-chloro-3-methyl-1,2-oxazol-4-yl)-N-[2-(2-methylphenyl)pyrazol-3-yl]propanamide (CID 126787813) is 3-(5-chloro-3-methyl-1,2-oxazol-4-yl)-N-[2-(2-methylphenyl)pyrazol-3-yl]propanamide.
What is the SMILES notation for 3-(5-chloro-3-methyl-1,2-oxazol-4-yl)-N-[2-(2-methylphenyl)pyrazol-3-yl]propanamide?
The canonical SMILES for 3-(5-chloro-3-methyl-1,2-oxazol-4-yl)-N-[2-(2-methylphenyl)pyrazol-3-yl]propanamide is Cc1ccccc1-n1nccc1NC(=O)CCc1c(C)noc1Cl.
What is the InChIKey of 3-(5-chloro-3-methyl-1,2-oxazol-4-yl)-N-[2-(2-methylphenyl)pyrazol-3-yl]propanamide?
The InChIKey is TYDDESHPGQFIGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17ClN4O2/c1-11-5-3-4-6-14(11)22-15(9-10-19-22)20-16(23)8-7-13-12(2)21-24-17(13)18/h3-6,9-10H,7-8H2,1-2H3,(H,20,23).
What are the key properties of 3-(5-chloro-3-methyl-1,2-oxazol-4-yl)-N-[2-(2-methylphenyl)pyrazol-3-yl]propanamide?
3-(5-chloro-3-methyl-1,2-oxazol-4-yl)-N-[2-(2-methylphenyl)pyrazol-3-yl]propanamide has a molecular weight of 344.80 g/mol, XLogP of 3.70, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-chloro-3-methyl-1,2-oxazol-4-yl)-N-[2-(2-methylphenyl)pyrazol-3-yl]propanamide is sourced from PubChem (CID 126787813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).