N-[3-(difluoromethoxy)phenyl]-1-(2-methoxy-5-methylphenyl)pyrazole-3-carboxamide

C19H17F2N3O3 — CID 48659408

IUPACN-[3-(difluoromethoxy)phenyl]-1-(2-methoxy-5-methylphenyl)pyrazole-3-carboxamide
SMILESCOc1ccc(C)cc1-n1ccc(C(=O)Nc2cccc(OC(F)F)c2)n1
InChIInChI=1S/C19H17F2N3O3/c1-12-6-7-17(26-2)16(10-12)24-9-8-15(23-24)18(25)22-13-4-3-5-14(11-13)27-19(20)21/h3-11,19H,1-2H3,(H,22,25)
InChIKeyVVSJDUDMDFUTSH-UHFFFAOYSA-N
MW373.36 g/mol
LogP4.04
Rot. Bonds6

About N-[3-(difluoromethoxy)phenyl]-1-(2-methoxy-5-methylphenyl)pyrazole-3-carboxamide

N-[3-(difluoromethoxy)phenyl]-1-(2-methoxy-5-methylphenyl)pyrazole-3-carboxamide (PubChem CID 48659408) has the molecular formula C19H17F2N3O3 and a molecular weight of 373.36 g/mol. Its IUPAC name is N-[3-(difluoromethoxy)phenyl]-1-(2-methoxy-5-methylphenyl)pyrazole-3-carboxamide.

Molecular Properties

Compound NameN-[3-(difluoromethoxy)phenyl]-1-(2-methoxy-5-methylphenyl)pyrazole-3-carboxamide
PubChem CID48659408
Molecular FormulaC19H17F2N3O3
Molecular Weight373.36 g/mol
Exact Mass373.12
IUPAC NameN-[3-(difluoromethoxy)phenyl]-1-(2-methoxy-5-methylphenyl)pyrazole-3-carboxamide
SMILESCOc1ccc(C)cc1-n1ccc(C(=O)Nc2cccc(OC(F)F)c2)n1
InChIInChI=1S/C19H17F2N3O3/c1-12-6-7-17(26-2)16(10-12)24-9-8-15(23-24)18(25)22-13-4-3-5-14(11-13)27-19(20)21/h3-11,19H,1-2H3,(H,22,25)
InChIKeyVVSJDUDMDFUTSH-UHFFFAOYSA-N
XLogP4.04
TPSA65.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.36
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(2-methoxy-5-methylphenyl)-N-(1-phenylpyrazol-4-yl)pyrazole-3-carboxamide
CID 71936851
N-[4-(ethylsulfonylamino)phenyl]-1-(2-methoxy-5-methylphenyl)pyrazole-3-carboxamide
CID 48678676
1-(2-methoxy-5-methylphenyl)-N-[2-(2-methoxyphenoxy)ethyl]pyrazole-3-carboxamide
CID 48652307
1-(2-methoxy-5-methylphenyl)-N-(2-propyl-1,3-dihydroisoindol-4-yl)pyrazole-3-carboxamide
CID 119041491
1-(2-methoxy-5-methylphenyl)-N-[3-(methylamino)propyl]pyrazole-3-carboxamide
CID 119430412
N-[(1-hydroxycyclobutyl)methyl]-1-(2-methoxy-5-methylphenyl)pyrazole-3-carboxamide
CID 111445526
1-(2-methoxy-5-methylphenyl)-N-(2-methylphenyl)sulfonylpyrazole-3-carboxamide
CID 48647201
2-[[1-(2-methoxy-5-methylphenyl)pyrazole-3-carbonyl]-methylamino]propanoic acid
CID 119209514
N-[3-(difluoromethoxy)phenyl]-2-fluoro-4-methylbenzamide
CID 79782174
N-[2-(furan-2-yl)-2-hydroxyethyl]-1-(2-methoxy-5-methylphenyl)pyrazole-3-carboxamide
CID 86848028
N-(4-aminocyclohexyl)-1-(2-methoxy-5-methylphenyl)pyrazole-3-carboxamide
CID 119475309
5-(2-methoxy-5-methylphenyl)-N-(3-methoxyphenyl)-1-methylpyrazole-3-carboxamide
CID 110336789

Frequently Asked Questions

What is the IUPAC name of N-[3-(difluoromethoxy)phenyl]-1-(2-methoxy-5-methylphenyl)pyrazole-3-carboxamide?
The IUPAC name of N-[3-(difluoromethoxy)phenyl]-1-(2-methoxy-5-methylphenyl)pyrazole-3-carboxamide (CID 48659408) is N-[3-(difluoromethoxy)phenyl]-1-(2-methoxy-5-methylphenyl)pyrazole-3-carboxamide.
What is the SMILES notation for N-[3-(difluoromethoxy)phenyl]-1-(2-methoxy-5-methylphenyl)pyrazole-3-carboxamide?
The canonical SMILES for N-[3-(difluoromethoxy)phenyl]-1-(2-methoxy-5-methylphenyl)pyrazole-3-carboxamide is COc1ccc(C)cc1-n1ccc(C(=O)Nc2cccc(OC(F)F)c2)n1.
What is the InChIKey of N-[3-(difluoromethoxy)phenyl]-1-(2-methoxy-5-methylphenyl)pyrazole-3-carboxamide?
The InChIKey is VVSJDUDMDFUTSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17F2N3O3/c1-12-6-7-17(26-2)16(10-12)24-9-8-15(23-24)18(25)22-13-4-3-5-14(11-13)27-19(20)21/h3-11,19H,1-2H3,(H,22,25).
What are the key properties of N-[3-(difluoromethoxy)phenyl]-1-(2-methoxy-5-methylphenyl)pyrazole-3-carboxamide?
N-[3-(difluoromethoxy)phenyl]-1-(2-methoxy-5-methylphenyl)pyrazole-3-carboxamide has a molecular weight of 373.36 g/mol, XLogP of 4.04, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(difluoromethoxy)phenyl]-1-(2-methoxy-5-methylphenyl)pyrazole-3-carboxamide is sourced from PubChem (CID 48659408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).