3-(difluoromethoxy)-4-methoxy-N-(4-methyl-1-phenylpyrazol-5-yl)benzamide

C19H17F2N3O3 — CID 75468505

IUPAC3-(difluoromethoxy)-4-methoxy-N-(4-methyl-1-phenylpyrazol-5-yl)benzamide
SMILESCOc1ccc(C(=O)Nc2c(C)cnn2-c2ccccc2)cc1OC(F)F
InChIInChI=1S/C19H17F2N3O3/c1-12-11-22-24(14-6-4-3-5-7-14)17(12)23-18(25)13-8-9-15(26-2)16(10-13)27-19(20)21/h3-11,19H,1-2H3,(H,23,25)
InChIKeyUUBQJDUDYMIBCW-UHFFFAOYSA-N
MW373.36 g/mol
LogP4.04
Rot. Bonds6

About 3-(difluoromethoxy)-4-methoxy-N-(4-methyl-1-phenylpyrazol-5-yl)benzamide

3-(difluoromethoxy)-4-methoxy-N-(4-methyl-1-phenylpyrazol-5-yl)benzamide (PubChem CID 75468505) has the molecular formula C19H17F2N3O3 and a molecular weight of 373.36 g/mol. Its IUPAC name is 3-(difluoromethoxy)-4-methoxy-N-(4-methyl-1-phenylpyrazol-5-yl)benzamide.

Molecular Properties

Compound Name3-(difluoromethoxy)-4-methoxy-N-(4-methyl-1-phenylpyrazol-5-yl)benzamide
PubChem CID75468505
Molecular FormulaC19H17F2N3O3
Molecular Weight373.36 g/mol
Exact Mass373.12
IUPAC Name3-(difluoromethoxy)-4-methoxy-N-(4-methyl-1-phenylpyrazol-5-yl)benzamide
SMILESCOc1ccc(C(=O)Nc2c(C)cnn2-c2ccccc2)cc1OC(F)F
InChIInChI=1S/C19H17F2N3O3/c1-12-11-22-24(14-6-4-3-5-7-14)17(12)23-18(25)13-8-9-15(26-2)16(10-13)27-19(20)21/h3-11,19H,1-2H3,(H,23,25)
InChIKeyUUBQJDUDYMIBCW-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

3,4,5-trimethoxy-N-(4-methyl-1-phenylpyrazol-5-yl)benzamide
CID 75468504
4-(difluoromethylsulfanyl)-N-(4-methyl-1-phenylpyrazol-5-yl)benzamide
CID 75468500
5-methoxy-N-(4-methyl-1-phenylpyrazol-5-yl)-2,3-dihydro-1,4-benzodioxine-7-carboxamide
CID 75468501
3-(difluoromethoxy)-N-(5-methyl-1-phenylpyrazol-4-yl)benzamide
CID 99625046
4-(difluoromethoxy)-3-methoxy-N-phenylbenzamide
CID 2171846
4-methoxy-N-(4-methyl-1-phenylpyrazol-5-yl)-1-phenylpyrazole-3-carboxamide
CID 167751714
4-(difluoromethoxy)-N-[2-(difluoromethoxy)phenyl]-3-methoxybenzamide
CID 8502681
N-(4-methyl-1-phenylpyrazol-5-yl)pyridine-3-carboxamide
CID 99818669
3-(difluoromethoxy)-4-methoxy-N-[(2-methylphenyl)methyl]benzamide
CID 46492035
2-(2,6-dimethoxyphenyl)-N-(4-methyl-1-phenylpyrazol-5-yl)acetamide
CID 75468723
4-(difluoromethoxy)-3-methoxy-N-(2-methylsulfanylphenyl)benzamide
CID 4864816
3-(difluoromethoxy)-4-methoxy-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)benzamide
CID 46493268

Frequently Asked Questions

What is the IUPAC name of 3-(difluoromethoxy)-4-methoxy-N-(4-methyl-1-phenylpyrazol-5-yl)benzamide?
The IUPAC name of 3-(difluoromethoxy)-4-methoxy-N-(4-methyl-1-phenylpyrazol-5-yl)benzamide (CID 75468505) is 3-(difluoromethoxy)-4-methoxy-N-(4-methyl-1-phenylpyrazol-5-yl)benzamide.
What is the SMILES notation for 3-(difluoromethoxy)-4-methoxy-N-(4-methyl-1-phenylpyrazol-5-yl)benzamide?
The canonical SMILES for 3-(difluoromethoxy)-4-methoxy-N-(4-methyl-1-phenylpyrazol-5-yl)benzamide is COc1ccc(C(=O)Nc2c(C)cnn2-c2ccccc2)cc1OC(F)F.
What is the InChIKey of 3-(difluoromethoxy)-4-methoxy-N-(4-methyl-1-phenylpyrazol-5-yl)benzamide?
The InChIKey is UUBQJDUDYMIBCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17F2N3O3/c1-12-11-22-24(14-6-4-3-5-7-14)17(12)23-18(25)13-8-9-15(26-2)16(10-13)27-19(20)21/h3-11,19H,1-2H3,(H,23,25).
What are the key properties of 3-(difluoromethoxy)-4-methoxy-N-(4-methyl-1-phenylpyrazol-5-yl)benzamide?
3-(difluoromethoxy)-4-methoxy-N-(4-methyl-1-phenylpyrazol-5-yl)benzamide 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 3-(difluoromethoxy)-4-methoxy-N-(4-methyl-1-phenylpyrazol-5-yl)benzamide is sourced from PubChem (CID 75468505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).