N-(2,4-dimethoxyphenyl)-1,5-dimethylindole-2-carboxamide

C19H20N2O3 — CID 7329099

IUPACN-(2,4-dimethoxyphenyl)-1,5-dimethylindole-2-carboxamide
SMILESCOc1ccc(NC(=O)c2cc3cc(C)ccc3n2C)c(OC)c1
InChIInChI=1S/C19H20N2O3/c1-12-5-8-16-13(9-12)10-17(21(16)2)19(22)20-15-7-6-14(23-3)11-18(15)24-4/h5-11H,1-4H3,(H,20,22)
InChIKeyRUZKZFVLOSTHPK-UHFFFAOYSA-N
MW324.38 g/mol
LogP3.76
Rot. Bonds4

About N-(2,4-dimethoxyphenyl)-1,5-dimethylindole-2-carboxamide

N-(2,4-dimethoxyphenyl)-1,5-dimethylindole-2-carboxamide (PubChem CID 7329099) has the molecular formula C19H20N2O3 and a molecular weight of 324.38 g/mol. Its IUPAC name is N-(2,4-dimethoxyphenyl)-1,5-dimethylindole-2-carboxamide.

Molecular Properties

Compound NameN-(2,4-dimethoxyphenyl)-1,5-dimethylindole-2-carboxamide
PubChem CID7329099
Molecular FormulaC19H20N2O3
Molecular Weight324.38 g/mol
Exact Mass324.15
IUPAC NameN-(2,4-dimethoxyphenyl)-1,5-dimethylindole-2-carboxamide
SMILESCOc1ccc(NC(=O)c2cc3cc(C)ccc3n2C)c(OC)c1
InChIInChI=1S/C19H20N2O3/c1-12-5-8-16-13(9-12)10-17(21(16)2)19(22)20-15-7-6-14(23-3)11-18(15)24-4/h5-11H,1-4H3,(H,20,22)
InChIKeyRUZKZFVLOSTHPK-UHFFFAOYSA-N
XLogP3.76
TPSA52.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethoxyphenyl)-1,5-dimethylindole-2-carboxamide?
The IUPAC name of N-(2,4-dimethoxyphenyl)-1,5-dimethylindole-2-carboxamide (CID 7329099) is N-(2,4-dimethoxyphenyl)-1,5-dimethylindole-2-carboxamide.
What is the SMILES notation for N-(2,4-dimethoxyphenyl)-1,5-dimethylindole-2-carboxamide?
The canonical SMILES for N-(2,4-dimethoxyphenyl)-1,5-dimethylindole-2-carboxamide is COc1ccc(NC(=O)c2cc3cc(C)ccc3n2C)c(OC)c1.
What is the InChIKey of N-(2,4-dimethoxyphenyl)-1,5-dimethylindole-2-carboxamide?
The InChIKey is RUZKZFVLOSTHPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O3/c1-12-5-8-16-13(9-12)10-17(21(16)2)19(22)20-15-7-6-14(23-3)11-18(15)24-4/h5-11H,1-4H3,(H,20,22).
What are the key properties of N-(2,4-dimethoxyphenyl)-1,5-dimethylindole-2-carboxamide?
N-(2,4-dimethoxyphenyl)-1,5-dimethylindole-2-carboxamide has a molecular weight of 324.38 g/mol, XLogP of 3.76, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethoxyphenyl)-1,5-dimethylindole-2-carboxamide is sourced from PubChem (CID 7329099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).