N-(4-ethylphenyl)-5-methoxy-3-methyl-1H-indole-2-carboxamide

C19H20N2O2 — CID 113204869

IUPACN-(4-ethylphenyl)-5-methoxy-3-methyl-1H-indole-2-carboxamide
SMILESCCc1ccc(NC(=O)c2[nH]c3ccc(OC)cc3c2C)cc1
InChIInChI=1S/C19H20N2O2/c1-4-13-5-7-14(8-6-13)20-19(22)18-12(2)16-11-15(23-3)9-10-17(16)21-18/h5-11,21H,4H2,1-3H3,(H,20,22)
InChIKeyFFRAXTDHIZPXCW-UHFFFAOYSA-N
MW308.38 g/mol
LogP4.30
Rot. Bonds4

About N-(4-ethylphenyl)-5-methoxy-3-methyl-1H-indole-2-carboxamide

N-(4-ethylphenyl)-5-methoxy-3-methyl-1H-indole-2-carboxamide (PubChem CID 113204869) has the molecular formula C19H20N2O2 and a molecular weight of 308.38 g/mol. Its IUPAC name is N-(4-ethylphenyl)-5-methoxy-3-methyl-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-(4-ethylphenyl)-5-methoxy-3-methyl-1H-indole-2-carboxamide
PubChem CID113204869
Molecular FormulaC19H20N2O2
Molecular Weight308.38 g/mol
Exact Mass308.15
IUPAC NameN-(4-ethylphenyl)-5-methoxy-3-methyl-1H-indole-2-carboxamide
SMILESCCc1ccc(NC(=O)c2[nH]c3ccc(OC)cc3c2C)cc1
InChIInChI=1S/C19H20N2O2/c1-4-13-5-7-14(8-6-13)20-19(22)18-12(2)16-11-15(23-3)9-10-17(16)21-18/h5-11,21H,4H2,1-3H3,(H,20,22)
InChIKeyFFRAXTDHIZPXCW-UHFFFAOYSA-N
XLogP4.30
TPSA54.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 54.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

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Related Compounds

N-(4-cyanophenyl)-5-methoxy-3-methyl-1H-indole-2-carboxamide
CID 113204938
N-(4-ethylphenyl)-3-methyl-1H-indole-2-carboxamide
CID 113204265
N-(3-chloro-4-methoxyphenyl)-5-methoxy-3-methyl-1H-indole-2-carboxamide
CID 113204882
methyl 2-[(5-methoxy-3-methyl-1H-indole-2-carbonyl)amino]benzoate
CID 113204904
6-methoxy-3-methyl-N-(4-propan-2-yloxyphenyl)-1H-indole-2-carboxamide
CID 113205504
N-(4-ethylphenyl)-6-methoxy-1H-indole-2-carboxamide
CID 46555962
5-methoxy-3-methyl-N-(3-methylbutyl)-1H-indole-2-carboxamide
CID 113204847
5-methoxy-3-methyl-N-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-7-yl)-1H-indole-2-carboxamide
CID 46978665
N-(4-ethylphenyl)-2-hydroxy-5-methoxybenzamide
CID 60716192
5-fluoro-3-methyl-N-(3,4,5-trimethoxyphenyl)-1H-indole-2-carboxamide
CID 113204658
6-methoxy-N-[(4-methoxyphenyl)methyl]-3-methyl-1H-indole-2-carboxamide
CID 113205411
ethyl 3-(ethoxycarbonylamino)-5-methoxy-1H-indole-2-carboxylate
CID 6615701

Frequently Asked Questions

What is the IUPAC name of N-(4-ethylphenyl)-5-methoxy-3-methyl-1H-indole-2-carboxamide?
The IUPAC name of N-(4-ethylphenyl)-5-methoxy-3-methyl-1H-indole-2-carboxamide (CID 113204869) is N-(4-ethylphenyl)-5-methoxy-3-methyl-1H-indole-2-carboxamide.
What is the SMILES notation for N-(4-ethylphenyl)-5-methoxy-3-methyl-1H-indole-2-carboxamide?
The canonical SMILES for N-(4-ethylphenyl)-5-methoxy-3-methyl-1H-indole-2-carboxamide is CCc1ccc(NC(=O)c2[nH]c3ccc(OC)cc3c2C)cc1.
What is the InChIKey of N-(4-ethylphenyl)-5-methoxy-3-methyl-1H-indole-2-carboxamide?
The InChIKey is FFRAXTDHIZPXCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O2/c1-4-13-5-7-14(8-6-13)20-19(22)18-12(2)16-11-15(23-3)9-10-17(16)21-18/h5-11,21H,4H2,1-3H3,(H,20,22).
What are the key properties of N-(4-ethylphenyl)-5-methoxy-3-methyl-1H-indole-2-carboxamide?
N-(4-ethylphenyl)-5-methoxy-3-methyl-1H-indole-2-carboxamide has a molecular weight of 308.38 g/mol, XLogP of 4.30, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethylphenyl)-5-methoxy-3-methyl-1H-indole-2-carboxamide is sourced from PubChem (CID 113204869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).