2,6-dimethoxy-N-[5-methyl-3-(5-methylfuran-2-yl)-1H-pyrazol-4-yl]benzamide

C18H19N3O4 — CID 42874269

IUPAC2,6-dimethoxy-N-[5-methyl-3-(5-methylfuran-2-yl)-1H-pyrazol-4-yl]benzamide
SMILESCOc1cccc(OC)c1C(=O)Nc1c(-c2ccc(C)o2)n[nH]c1C
InChIInChI=1S/C18H19N3O4/c1-10-8-9-14(25-10)17-16(11(2)20-21-17)19-18(22)15-12(23-3)6-5-7-13(15)24-4/h5-9H,1-4H3,(H,19,22)(H,20,21)
InChIKeyIHHOXGXMISXFNQ-UHFFFAOYSA-N
MW341.37 g/mol
LogP3.56
Rot. Bonds5

About 2,6-dimethoxy-N-[5-methyl-3-(5-methylfuran-2-yl)-1H-pyrazol-4-yl]benzamide

2,6-dimethoxy-N-[5-methyl-3-(5-methylfuran-2-yl)-1H-pyrazol-4-yl]benzamide (PubChem CID 42874269) has the molecular formula C18H19N3O4 and a molecular weight of 341.37 g/mol. Its IUPAC name is 2,6-dimethoxy-N-[5-methyl-3-(5-methylfuran-2-yl)-1H-pyrazol-4-yl]benzamide.

Molecular Properties

Compound Name2,6-dimethoxy-N-[5-methyl-3-(5-methylfuran-2-yl)-1H-pyrazol-4-yl]benzamide
PubChem CID42874269
Molecular FormulaC18H19N3O4
Molecular Weight341.37 g/mol
Exact Mass341.14
IUPAC Name2,6-dimethoxy-N-[5-methyl-3-(5-methylfuran-2-yl)-1H-pyrazol-4-yl]benzamide
SMILESCOc1cccc(OC)c1C(=O)Nc1c(-c2ccc(C)o2)n[nH]c1C
InChIInChI=1S/C18H19N3O4/c1-10-8-9-14(25-10)17-16(11(2)20-21-17)19-18(22)15-12(23-3)6-5-7-13(15)24-4/h5-9H,1-4H3,(H,19,22)(H,20,21)
InChIKeyIHHOXGXMISXFNQ-UHFFFAOYSA-N
XLogP3.56
TPSA89.38 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.37
LogP ≤ 53.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3,4-dichloro-N-[5-methyl-3-(5-methylfuran-2-yl)-1H-pyrazol-4-yl]benzamide
CID 42874266
N-[3-(2,5-dimethoxyphenyl)-5-methyl-1H-pyrazol-4-yl]benzamide
CID 42685754
N-(2-cyano-6-methoxyphenyl)-3,5-dimethyl-1H-pyrazole-4-carboxamide
CID 107468982
methyl 3-(5-methylfuran-2-yl)-1H-pyrazole-5-carboxylate
CID 4737236
N-[3-(2,5-dimethoxyphenyl)-5-methyl-1H-pyrazol-4-yl]-3,4-dimethoxybenzamide
CID 42685772
N-(2,6-dichlorophenyl)-2,6-dimethoxybenzamide
CID 3653582
N-[3-(2,4-dimethoxyphenyl)-5-methyl-1H-pyrazol-4-yl]thiophene-2-carboxamide
CID 42686773
N-[3-(2,5-dimethoxyphenyl)-5-methyl-1H-pyrazol-4-yl]-2-(4-methoxyphenyl)acetamide
CID 42685763
N-(3,5-dimethyl-1H-pyrazol-4-yl)-2,6-difluorobenzamide
CID 43546935
N-(5-methyl-3-phenyl-1H-pyrazol-4-yl)benzamide
CID 14183157
2-(4-methoxyphenyl)-N-[3-(4-methoxyphenyl)-5-methyl-1H-pyrazol-4-yl]acetamide
CID 42687579
N-(4-chloro-2-methoxy-5-methylphenyl)-5-(5-methylfuran-2-yl)-1H-pyrazole-3-carboxamide
CID 112828951

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethoxy-N-[5-methyl-3-(5-methylfuran-2-yl)-1H-pyrazol-4-yl]benzamide?
The IUPAC name of 2,6-dimethoxy-N-[5-methyl-3-(5-methylfuran-2-yl)-1H-pyrazol-4-yl]benzamide (CID 42874269) is 2,6-dimethoxy-N-[5-methyl-3-(5-methylfuran-2-yl)-1H-pyrazol-4-yl]benzamide.
What is the SMILES notation for 2,6-dimethoxy-N-[5-methyl-3-(5-methylfuran-2-yl)-1H-pyrazol-4-yl]benzamide?
The canonical SMILES for 2,6-dimethoxy-N-[5-methyl-3-(5-methylfuran-2-yl)-1H-pyrazol-4-yl]benzamide is COc1cccc(OC)c1C(=O)Nc1c(-c2ccc(C)o2)n[nH]c1C.
What is the InChIKey of 2,6-dimethoxy-N-[5-methyl-3-(5-methylfuran-2-yl)-1H-pyrazol-4-yl]benzamide?
The InChIKey is IHHOXGXMISXFNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O4/c1-10-8-9-14(25-10)17-16(11(2)20-21-17)19-18(22)15-12(23-3)6-5-7-13(15)24-4/h5-9H,1-4H3,(H,19,22)(H,20,21).
What are the key properties of 2,6-dimethoxy-N-[5-methyl-3-(5-methylfuran-2-yl)-1H-pyrazol-4-yl]benzamide?
2,6-dimethoxy-N-[5-methyl-3-(5-methylfuran-2-yl)-1H-pyrazol-4-yl]benzamide has a molecular weight of 341.37 g/mol, XLogP of 3.56, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethoxy-N-[5-methyl-3-(5-methylfuran-2-yl)-1H-pyrazol-4-yl]benzamide is sourced from PubChem (CID 42874269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).