2-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]furan-3-carboxamide

C21H19N3O2 — CID 118335580

IUPAC2-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]furan-3-carboxamide
SMILESCc1ccc(Cn2nc(NC(=O)c3ccoc3C)c3ccccc32)cc1
InChIInChI=1S/C21H19N3O2/c1-14-7-9-16(10-8-14)13-24-19-6-4-3-5-18(19)20(23-24)22-21(25)17-11-12-26-15(17)2/h3-12H,13H2,1-2H3,(H,22,23,25)
InChIKeyWURJLQOTBFDTCG-UHFFFAOYSA-N
MW345.40 g/mol
LogP4.55
Rot. Bonds4

About 2-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]furan-3-carboxamide

2-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]furan-3-carboxamide (PubChem CID 118335580) has the molecular formula C21H19N3O2 and a molecular weight of 345.40 g/mol. Its IUPAC name is 2-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]furan-3-carboxamide.

Molecular Properties

Compound Name2-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]furan-3-carboxamide
PubChem CID118335580
Molecular FormulaC21H19N3O2
Molecular Weight345.40 g/mol
Exact Mass345.15
IUPAC Name2-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]furan-3-carboxamide
SMILESCc1ccc(Cn2nc(NC(=O)c3ccoc3C)c3ccccc32)cc1
InChIInChI=1S/C21H19N3O2/c1-14-7-9-16(10-8-14)13-24-19-6-4-3-5-18(19)20(23-24)22-21(25)17-11-12-26-15(17)2/h3-12H,13H2,1-2H3,(H,22,23,25)
InChIKeyWURJLQOTBFDTCG-UHFFFAOYSA-N
XLogP4.55
TPSA60.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.40
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-Methyl-N-(1-((4-(trifluoromethyl)phenyl)methyl)-1H-indazol-3-yl)-3-furancarboxamide
CID 91844684
N-(1-((4-(trifluoromethyl)phenyl)methyl)-1H-indazol-3-yl)furan-2-carboxamide
CID 73331364
5-Amino-3-methyl-4-phenylpyrazolyl 2-methyl(3-furyl) ketone
CID 1263280
N-(1-methyl-1H-indazol-3-yl)furan-2-carboxamide
CID 70680254
N-(4-methoxy-1-methylindazol-3-yl)-2,5-dimethyluran-3-carboxamide
CID 2811420
N-(2,5-dimethylpyrazol-3-yl)-2,5-dimethylfuran-3-carboxamide
CID 2811734
3-methoxy-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide
CID 172434181
N-(1H-indazol-3-yl)furan-3-carboxamide
CID 55023356
4,5-dimethyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-2-carboxamide
CID 118326010
N-[1-[[3-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide
CID 118326026
N-[1-[[6-(trifluoromethyl)pyridin-3-yl]methyl]indazol-3-yl]furan-3-carboxamide
CID 118326029
N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-2-methylfuran-3-carboxamide
CID 118335350

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]furan-3-carboxamide?
The IUPAC name of 2-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]furan-3-carboxamide (CID 118335580) is 2-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]furan-3-carboxamide.
What is the SMILES notation for 2-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]furan-3-carboxamide?
The canonical SMILES for 2-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]furan-3-carboxamide is Cc1ccc(Cn2nc(NC(=O)c3ccoc3C)c3ccccc32)cc1.
What is the InChIKey of 2-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]furan-3-carboxamide?
The InChIKey is WURJLQOTBFDTCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N3O2/c1-14-7-9-16(10-8-14)13-24-19-6-4-3-5-18(19)20(23-24)22-21(25)17-11-12-26-15(17)2/h3-12H,13H2,1-2H3,(H,22,23,25).
What are the key properties of 2-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]furan-3-carboxamide?
2-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]furan-3-carboxamide has a molecular weight of 345.40 g/mol, XLogP of 4.55, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]furan-3-carboxamide is sourced from PubChem (CID 118335580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).