5-methyl-N-(4-propoxyphenyl)-1H-indole-2-carboxamide

C19H20N2O2 — CID 5160710

IUPAC5-methyl-N-(4-propoxyphenyl)-1H-indole-2-carboxamide
SMILESCCCOc1ccc(NC(=O)c2cc3cc(C)ccc3[nH]2)cc1
InChIInChI=1S/C19H20N2O2/c1-3-10-23-16-7-5-15(6-8-16)20-19(22)18-12-14-11-13(2)4-9-17(14)21-18/h4-9,11-12,21H,3,10H2,1-2H3,(H,20,22)
InChIKeyOUVALDHXOHEJGF-UHFFFAOYSA-N
MW308.38 g/mol
LogP4.52
Rot. Bonds5

About 5-methyl-N-(4-propoxyphenyl)-1H-indole-2-carboxamide

5-methyl-N-(4-propoxyphenyl)-1H-indole-2-carboxamide (PubChem CID 5160710) has the molecular formula C19H20N2O2 and a molecular weight of 308.38 g/mol. Its IUPAC name is 5-methyl-N-(4-propoxyphenyl)-1H-indole-2-carboxamide.

Molecular Properties

Compound Name5-methyl-N-(4-propoxyphenyl)-1H-indole-2-carboxamide
PubChem CID5160710
Molecular FormulaC19H20N2O2
Molecular Weight308.38 g/mol
Exact Mass308.15
IUPAC Name5-methyl-N-(4-propoxyphenyl)-1H-indole-2-carboxamide
SMILESCCCOc1ccc(NC(=O)c2cc3cc(C)ccc3[nH]2)cc1
InChIInChI=1S/C19H20N2O2/c1-3-10-23-16-7-5-15(6-8-16)20-19(22)18-12-14-11-13(2)4-9-17(14)21-18/h4-9,11-12,21H,3,10H2,1-2H3,(H,20,22)
InChIKeyOUVALDHXOHEJGF-UHFFFAOYSA-N
XLogP4.52
TPSA54.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 54.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

Asp-9521
CID 25210792
2,3,4,9-Tetrahydro-6-methoxy-1H-pyrido(3,4-b)indol-1-one
CID 87372
methyl 6-methoxy-9H-carbazole-3-carboxylate
CID 14804151
5-(phenylmethoxy)-1H-indole-2-carboxylic acid
CID 81146
6-methoxy-9H-carbazole-3-carbaldehyde
CID 5278452
[4-({[5-Benzyloxy-1-(3-Carbamimidoyl-Benzyl)-1h-Indole-2-Carbonyl]-Amino}-Methyl)-Phenyl]-Trimethyl-Ammonium
CID 446978
N-(1-Isopropylpiperidin-4-YL)-1-(3-methoxybenzyl)-1H-indole-2-carboxamide
CID 6540267
2-(1H-indol-3-yl)-N-(4-methoxyphenyl)-2-oxoacetamide
CID 5315108
Piperazine, 1-((5-methoxyindol-2-yl)carbonyl)-4-methyl-
CID 206876
D-64131
CID 3921152
Bis(1H-2-indolyl)methanone 11
CID 5330527
Bis(1H-2-indolyl)methanone 45
CID 5330541

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(4-propoxyphenyl)-1H-indole-2-carboxamide?
The IUPAC name of 5-methyl-N-(4-propoxyphenyl)-1H-indole-2-carboxamide (CID 5160710) is 5-methyl-N-(4-propoxyphenyl)-1H-indole-2-carboxamide.
What is the SMILES notation for 5-methyl-N-(4-propoxyphenyl)-1H-indole-2-carboxamide?
The canonical SMILES for 5-methyl-N-(4-propoxyphenyl)-1H-indole-2-carboxamide is CCCOc1ccc(NC(=O)c2cc3cc(C)ccc3[nH]2)cc1.
What is the InChIKey of 5-methyl-N-(4-propoxyphenyl)-1H-indole-2-carboxamide?
The InChIKey is OUVALDHXOHEJGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O2/c1-3-10-23-16-7-5-15(6-8-16)20-19(22)18-12-14-11-13(2)4-9-17(14)21-18/h4-9,11-12,21H,3,10H2,1-2H3,(H,20,22).
What are the key properties of 5-methyl-N-(4-propoxyphenyl)-1H-indole-2-carboxamide?
5-methyl-N-(4-propoxyphenyl)-1H-indole-2-carboxamide has a molecular weight of 308.38 g/mol, XLogP of 4.52, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(4-propoxyphenyl)-1H-indole-2-carboxamide is sourced from PubChem (CID 5160710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).