N-(2,6-diethylphenyl)-1H-indole-3-carboxamide

C19H20N2O — CID 113205558

IUPACN-(2,6-diethylphenyl)-1H-indole-3-carboxamide
SMILESCCc1cccc(CC)c1NC(=O)c1c[nH]c2ccccc12
InChIInChI=1S/C19H20N2O/c1-3-13-8-7-9-14(4-2)18(13)21-19(22)16-12-20-17-11-6-5-10-15(16)17/h5-12,20H,3-4H2,1-2H3,(H,21,22)
InChIKeyUPOHUVFNIMKEIO-UHFFFAOYSA-N
MW292.38 g/mol
LogP4.55
Rot. Bonds4

About N-(2,6-diethylphenyl)-1H-indole-3-carboxamide

N-(2,6-diethylphenyl)-1H-indole-3-carboxamide (PubChem CID 113205558) has the molecular formula C19H20N2O and a molecular weight of 292.38 g/mol. Its IUPAC name is N-(2,6-diethylphenyl)-1H-indole-3-carboxamide.

Molecular Properties

Compound NameN-(2,6-diethylphenyl)-1H-indole-3-carboxamide
PubChem CID113205558
Molecular FormulaC19H20N2O
Molecular Weight292.38 g/mol
Exact Mass292.16
IUPAC NameN-(2,6-diethylphenyl)-1H-indole-3-carboxamide
SMILESCCc1cccc(CC)c1NC(=O)c1c[nH]c2ccccc12
InChIInChI=1S/C19H20N2O/c1-3-13-8-7-9-14(4-2)18(13)21-19(22)16-12-20-17-11-6-5-10-15(16)17/h5-12,20H,3-4H2,1-2H3,(H,21,22)
InChIKeyUPOHUVFNIMKEIO-UHFFFAOYSA-N
XLogP4.55
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 54.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2,6-diethylphenyl)-6-fluoro-1H-indole-3-carboxamide
CID 113206252
N-(2,6-diethylphenyl)-5,6-dimethoxy-1H-indole-3-carboxamide
CID 113206966
N-(4-ethylphenyl)-1H-indole-3-carboxamide;molecular hydrogen
CID 159635618
N-(1,3,5-trimethylpyrazol-4-yl)-1H-indole-3-carboxamide
CID 47113057
N-(2-bromo-6-fluorophenyl)-1H-indole-3-carboxamide
CID 107602604
N'-(2,6-diethylphenyl)-N-[2-(1H-indol-3-yl)ethyl]oxamide
CID 108511537
N-(2-hydroxyphenyl)-1H-indole-3-carboxamide
CID 57210773
N-(3,5-dimethylphenyl)-1H-indole-3-carboxamide
CID 43399253
N-butan-2-yl-1H-indole-3-carboxamide
CID 43399203
N-(2-chloro-4,6-dimethylphenyl)-1H-indole-3-carboxamide
CID 113205562
N-(3-methyl-2-oxobutyl)-1H-indole-3-carboxamide
CID 59531603
N-(2,3-dichlorophenyl)-1H-indole-3-carboxamide
CID 43399264

Frequently Asked Questions

What is the IUPAC name of N-(2,6-diethylphenyl)-1H-indole-3-carboxamide?
The IUPAC name of N-(2,6-diethylphenyl)-1H-indole-3-carboxamide (CID 113205558) is N-(2,6-diethylphenyl)-1H-indole-3-carboxamide.
What is the SMILES notation for N-(2,6-diethylphenyl)-1H-indole-3-carboxamide?
The canonical SMILES for N-(2,6-diethylphenyl)-1H-indole-3-carboxamide is CCc1cccc(CC)c1NC(=O)c1c[nH]c2ccccc12.
What is the InChIKey of N-(2,6-diethylphenyl)-1H-indole-3-carboxamide?
The InChIKey is UPOHUVFNIMKEIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O/c1-3-13-8-7-9-14(4-2)18(13)21-19(22)16-12-20-17-11-6-5-10-15(16)17/h5-12,20H,3-4H2,1-2H3,(H,21,22).
What are the key properties of N-(2,6-diethylphenyl)-1H-indole-3-carboxamide?
N-(2,6-diethylphenyl)-1H-indole-3-carboxamide has a molecular weight of 292.38 g/mol, XLogP of 4.55, 4 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-diethylphenyl)-1H-indole-3-carboxamide is sourced from PubChem (CID 113205558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).