1-[(3-methyl-1,2-oxazol-5-yl)methyl]-5-phenyl-N-[[3-(trifluoromethyl)phenyl]methyl]pyrazole-3-carboxamide

C23H19F3N4O2 — CID 24982225

IUPAC1-[(3-methyl-1,2-oxazol-5-yl)methyl]-5-phenyl-N-[[3-(trifluoromethyl)phenyl]methyl]pyrazole-3-carboxamide
SMILESCc1cc(Cn2nc(C(=O)NCc3cccc(C(F)(F)F)c3)cc2-c2ccccc2)on1
InChIInChI=1S/C23H19F3N4O2/c1-15-10-19(32-29-15)14-30-21(17-7-3-2-4-8-17)12-20(28-30)22(31)27-13-16-6-5-9-18(11-16)23(24,25)26/h2-12H,13-14H2,1H3,(H,27,31)
InChIKeyQCHFCWKIEKEZSD-UHFFFAOYSA-N
MW440.43 g/mol
LogP4.84
Rot. Bonds6

About 1-[(3-methyl-1,2-oxazol-5-yl)methyl]-5-phenyl-N-[[3-(trifluoromethyl)phenyl]methyl]pyrazole-3-carboxamide

1-[(3-methyl-1,2-oxazol-5-yl)methyl]-5-phenyl-N-[[3-(trifluoromethyl)phenyl]methyl]pyrazole-3-carboxamide (PubChem CID 24982225) has the molecular formula C23H19F3N4O2 and a molecular weight of 440.43 g/mol. Its IUPAC name is 1-[(3-methyl-1,2-oxazol-5-yl)methyl]-5-phenyl-N-[[3-(trifluoromethyl)phenyl]methyl]pyrazole-3-carboxamide.

Molecular Properties

Compound Name1-[(3-methyl-1,2-oxazol-5-yl)methyl]-5-phenyl-N-[[3-(trifluoromethyl)phenyl]methyl]pyrazole-3-carboxamide
PubChem CID24982225
Molecular FormulaC23H19F3N4O2
Molecular Weight440.43 g/mol
Exact Mass440.15
IUPAC Name1-[(3-methyl-1,2-oxazol-5-yl)methyl]-5-phenyl-N-[[3-(trifluoromethyl)phenyl]methyl]pyrazole-3-carboxamide
SMILESCc1cc(Cn2nc(C(=O)NCc3cccc(C(F)(F)F)c3)cc2-c2ccccc2)on1
InChIInChI=1S/C23H19F3N4O2/c1-15-10-19(32-29-15)14-30-21(17-7-3-2-4-8-17)12-20(28-30)22(31)27-13-16-6-5-9-18(11-16)23(24,25)26/h2-12H,13-14H2,1H3,(H,27,31)
InChIKeyQCHFCWKIEKEZSD-UHFFFAOYSA-N
XLogP4.84
TPSA72.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500440.43
LogP ≤ 54.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-[(3-methyl-1,2-oxazol-5-yl)methyl]-5-phenyl-N-[[3-(trifluoromethyl)phenyl]methyl]pyrazole-3-carboxamide 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

N-[1-(2,4-difluorophenyl)-4,5,6,7-tetrahydroindazol-4-yl]-5-ethyl-3-isoxazolecarboxamide
CID 44182100
N-[3,5-dimethyl-1-(4-methylbenzyl)-1H-pyrazol-4-yl]-3-methyl-5-isoxazolecarboxamide
CID 9550989
N-[1-[(4-fluorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-3-methyl-1,2-oxazole-5-carboxamide
CID 9550990
N-[3,5-dimethyl-1-(2-methylbenzyl)-1H-pyrazol-4-yl]-5-isobutylisoxazole-3-carboxamide
CID 15988813
N-(cyclopropylmethyl)-1-[(3-ethyl-1,2-oxazol-5-yl)methyl]-3-phenylpyrazole-5-carboxamide
CID 24980474
N-(cyclopropylmethyl)-1-[(3-methyl-1,2-oxazol-5-yl)methyl]-5-phenylpyrazole-3-carboxamide
CID 24980536
N-[(2-methoxyphenyl)methyl]-1-[(3-methyl-1,2-oxazol-5-yl)methyl]-3-phenylpyrazole-5-carboxamide
CID 24980539
1-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N-[(4-methylphenyl)methyl]-3-phenylpyrazole-5-carboxamide
CID 24980540
N-[(3-bromophenyl)methyl]-1-[(3-methyl-1,2-oxazol-5-yl)methyl]-5-phenylpyrazole-3-carboxamide
CID 24982194
N-(2-methoxyethyl)-1-[(3-methyl-1,2-oxazol-5-yl)methyl]-5-phenylpyrazole-3-carboxamide
CID 24982195
1-[(3-ethyl-1,2-oxazol-5-yl)methyl]-3-phenyl-N-(thiophen-2-ylmethyl)pyrazole-5-carboxamide
CID 24982323
1-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N-[(2-methoxyphenyl)methyl]-3-phenylpyrazole-5-carboxamide
CID 24982499

Frequently Asked Questions

What is the IUPAC name of 1-[(3-methyl-1,2-oxazol-5-yl)methyl]-5-phenyl-N-[[3-(trifluoromethyl)phenyl]methyl]pyrazole-3-carboxamide?
The IUPAC name of 1-[(3-methyl-1,2-oxazol-5-yl)methyl]-5-phenyl-N-[[3-(trifluoromethyl)phenyl]methyl]pyrazole-3-carboxamide (CID 24982225) is 1-[(3-methyl-1,2-oxazol-5-yl)methyl]-5-phenyl-N-[[3-(trifluoromethyl)phenyl]methyl]pyrazole-3-carboxamide.
What is the SMILES notation for 1-[(3-methyl-1,2-oxazol-5-yl)methyl]-5-phenyl-N-[[3-(trifluoromethyl)phenyl]methyl]pyrazole-3-carboxamide?
The canonical SMILES for 1-[(3-methyl-1,2-oxazol-5-yl)methyl]-5-phenyl-N-[[3-(trifluoromethyl)phenyl]methyl]pyrazole-3-carboxamide is Cc1cc(Cn2nc(C(=O)NCc3cccc(C(F)(F)F)c3)cc2-c2ccccc2)on1.
What is the InChIKey of 1-[(3-methyl-1,2-oxazol-5-yl)methyl]-5-phenyl-N-[[3-(trifluoromethyl)phenyl]methyl]pyrazole-3-carboxamide?
The InChIKey is QCHFCWKIEKEZSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19F3N4O2/c1-15-10-19(32-29-15)14-30-21(17-7-3-2-4-8-17)12-20(28-30)22(31)27-13-16-6-5-9-18(11-16)23(24,25)26/h2-12H,13-14H2,1H3,(H,27,31).
What are the key properties of 1-[(3-methyl-1,2-oxazol-5-yl)methyl]-5-phenyl-N-[[3-(trifluoromethyl)phenyl]methyl]pyrazole-3-carboxamide?
1-[(3-methyl-1,2-oxazol-5-yl)methyl]-5-phenyl-N-[[3-(trifluoromethyl)phenyl]methyl]pyrazole-3-carboxamide has a molecular weight of 440.43 g/mol, XLogP of 4.84, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3-methyl-1,2-oxazol-5-yl)methyl]-5-phenyl-N-[[3-(trifluoromethyl)phenyl]methyl]pyrazole-3-carboxamide is sourced from PubChem (CID 24982225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).