3-(furan-2-yl)-5-methyl-N-(2-methylphenyl)-1H-pyrazole-4-carboxamide

C16H15N3O2 — CID 110682318

IUPAC3-(furan-2-yl)-5-methyl-N-(2-methylphenyl)-1H-pyrazole-4-carboxamide
SMILESCc1ccccc1NC(=O)c1c(-c2ccco2)n[nH]c1C
InChIInChI=1S/C16H15N3O2/c1-10-6-3-4-7-12(10)17-16(20)14-11(2)18-19-15(14)13-8-5-9-21-13/h3-9H,1-2H3,(H,17,20)(H,18,19)
InChIKeyDDIQCBNQEIKOLB-UHFFFAOYSA-N
MW281.31 g/mol
LogP3.54
Rot. Bonds3

About 3-(furan-2-yl)-5-methyl-N-(2-methylphenyl)-1H-pyrazole-4-carboxamide

3-(furan-2-yl)-5-methyl-N-(2-methylphenyl)-1H-pyrazole-4-carboxamide (PubChem CID 110682318) has the molecular formula C16H15N3O2 and a molecular weight of 281.31 g/mol. Its IUPAC name is 3-(furan-2-yl)-5-methyl-N-(2-methylphenyl)-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound Name3-(furan-2-yl)-5-methyl-N-(2-methylphenyl)-1H-pyrazole-4-carboxamide
PubChem CID110682318
Molecular FormulaC16H15N3O2
Molecular Weight281.31 g/mol
Exact Mass281.12
IUPAC Name3-(furan-2-yl)-5-methyl-N-(2-methylphenyl)-1H-pyrazole-4-carboxamide
SMILESCc1ccccc1NC(=O)c1c(-c2ccco2)n[nH]c1C
InChIInChI=1S/C16H15N3O2/c1-10-6-3-4-7-12(10)17-16(20)14-11(2)18-19-15(14)13-8-5-9-21-13/h3-9H,1-2H3,(H,17,20)(H,18,19)
InChIKeyDDIQCBNQEIKOLB-UHFFFAOYSA-N
XLogP3.54
TPSA70.92 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.31
LogP ≤ 53.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-chlorophenyl)-3-(furan-2-yl)-5-methyl-1H-pyrazole-4-carboxamide
CID 110682329
N-(4-carbamoylphenyl)-3-(furan-2-yl)-5-methyl-1H-pyrazole-4-carboxamide
CID 110682346
3-(furan-2-yl)-N-[(2-methoxyphenyl)methyl]-5-methyl-1H-pyrazole-4-carboxamide
CID 110682270
5-cyano-4-(furan-2-yl)-2-methyl-N-(2-methylphenyl)-6-sulfanylidene-1H-pyridine-3-carboxamide
CID 920217
N-(2-fluoro-3-methylphenyl)-3,5-dimethyl-1H-pyrazole-4-carboxamide
CID 113352500
[3-(furan-2-yl)-5-methyl-1H-pyrazol-4-yl]methanol
CID 54851051
ethyl 4-[3-(furan-2-yl)-5-methyl-1H-pyrazole-4-carbonyl]piperazine-1-carboxylate
CID 110682300
N-[2-[5-(furan-2-yl)-1H-pyrazol-3-yl]phenyl]-4-methylbenzamide
CID 122425162
2,6-dihydroxy-N-(2-methylphenyl)benzamide
CID 113347043
2-(furan-2-yl)-6-methyl-N-(2-methylphenyl)-4-oxo-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide
CID 23040873
5-(furan-2-yl)-N-[2-(propan-2-ylcarbamoyl)phenyl]-1H-pyrazole-3-carboxamide
CID 34564904
N-[4-[(2-methylphenyl)carbamoyl]phenyl]furan-2-carboxamide
CID 872367

Frequently Asked Questions

What is the IUPAC name of 3-(furan-2-yl)-5-methyl-N-(2-methylphenyl)-1H-pyrazole-4-carboxamide?
The IUPAC name of 3-(furan-2-yl)-5-methyl-N-(2-methylphenyl)-1H-pyrazole-4-carboxamide (CID 110682318) is 3-(furan-2-yl)-5-methyl-N-(2-methylphenyl)-1H-pyrazole-4-carboxamide.
What is the SMILES notation for 3-(furan-2-yl)-5-methyl-N-(2-methylphenyl)-1H-pyrazole-4-carboxamide?
The canonical SMILES for 3-(furan-2-yl)-5-methyl-N-(2-methylphenyl)-1H-pyrazole-4-carboxamide is Cc1ccccc1NC(=O)c1c(-c2ccco2)n[nH]c1C.
What is the InChIKey of 3-(furan-2-yl)-5-methyl-N-(2-methylphenyl)-1H-pyrazole-4-carboxamide?
The InChIKey is DDIQCBNQEIKOLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O2/c1-10-6-3-4-7-12(10)17-16(20)14-11(2)18-19-15(14)13-8-5-9-21-13/h3-9H,1-2H3,(H,17,20)(H,18,19).
What are the key properties of 3-(furan-2-yl)-5-methyl-N-(2-methylphenyl)-1H-pyrazole-4-carboxamide?
3-(furan-2-yl)-5-methyl-N-(2-methylphenyl)-1H-pyrazole-4-carboxamide has a molecular weight of 281.31 g/mol, XLogP of 3.54, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(furan-2-yl)-5-methyl-N-(2-methylphenyl)-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 110682318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).