N-(2,6-dimethoxyphenyl)-2-methyl-2,3-dihydroindole-1-carboxamide

C18H20N2O3 — CID 108868023

IUPACN-(2,6-dimethoxyphenyl)-2-methyl-2,3-dihydroindole-1-carboxamide
SMILESCOc1cccc(OC)c1NC(=O)N1c2ccccc2CC1C
InChIInChI=1S/C18H20N2O3/c1-12-11-13-7-4-5-8-14(13)20(12)18(21)19-17-15(22-2)9-6-10-16(17)23-3/h4-10,12H,11H2,1-3H3,(H,19,21)
InChIKeyRTQUIXGADJPGFQ-UHFFFAOYSA-N
MW312.37 g/mol
LogP3.69
Rot. Bonds3

About N-(2,6-dimethoxyphenyl)-2-methyl-2,3-dihydroindole-1-carboxamide

N-(2,6-dimethoxyphenyl)-2-methyl-2,3-dihydroindole-1-carboxamide (PubChem CID 108868023) has the molecular formula C18H20N2O3 and a molecular weight of 312.37 g/mol. Its IUPAC name is N-(2,6-dimethoxyphenyl)-2-methyl-2,3-dihydroindole-1-carboxamide.

Molecular Properties

Compound NameN-(2,6-dimethoxyphenyl)-2-methyl-2,3-dihydroindole-1-carboxamide
PubChem CID108868023
Molecular FormulaC18H20N2O3
Molecular Weight312.37 g/mol
Exact Mass312.15
IUPAC NameN-(2,6-dimethoxyphenyl)-2-methyl-2,3-dihydroindole-1-carboxamide
SMILESCOc1cccc(OC)c1NC(=O)N1c2ccccc2CC1C
InChIInChI=1S/C18H20N2O3/c1-12-11-13-7-4-5-8-14(13)20(12)18(21)19-17-15(22-2)9-6-10-16(17)23-3/h4-10,12H,11H2,1-3H3,(H,19,21)
InChIKeyRTQUIXGADJPGFQ-UHFFFAOYSA-N
XLogP3.69
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2,6-dimethoxyphenyl)-(2-methyl-2,3-dihydroindol-1-yl)methanone
CID 17319734
(2-methoxyphenyl)-(2-methyl-2,3-dihydroindol-1-yl)methanone
CID 19061805
N-(3-hydroxyphenyl)-2-methyl-2,3-dihydroindole-1-carboxamide
CID 108895859
N-(2-ethoxyphenyl)-2-methyl-2,3-dihydroindole-1-carboxamide
CID 108992032
N-(2-ethylphenyl)-2-methyl-2,3-dihydroindole-1-carboxamide
CID 108991479
2-methyl-N-(4-propan-2-ylphenyl)-2,3-dihydroindole-1-carboxamide
CID 108991651
2-methyl-N-(3,4,5-triethoxyphenyl)-2,3-dihydroindole-1-carboxamide
CID 108869872
(3-methoxynaphthalen-2-yl)-[(2S)-2-methyl-2,3-dihydroindol-1-yl]methanone
CID 26910968
2-methyl-N-(5-methyl-1,2-oxazol-3-yl)-2,3-dihydroindole-1-carboxamide
CID 42922545
2-methyl-N-(4-nitrophenyl)-2,3-dihydroindole-1-carboxamide
CID 2944621
[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl] 2-hydroxy-3-methoxybenzoate
CID 18075553
[(2R)-1-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-1-oxopropan-2-yl] 2-methoxybenzoate
CID 7485583

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dimethoxyphenyl)-2-methyl-2,3-dihydroindole-1-carboxamide?
The IUPAC name of N-(2,6-dimethoxyphenyl)-2-methyl-2,3-dihydroindole-1-carboxamide (CID 108868023) is N-(2,6-dimethoxyphenyl)-2-methyl-2,3-dihydroindole-1-carboxamide.
What is the SMILES notation for N-(2,6-dimethoxyphenyl)-2-methyl-2,3-dihydroindole-1-carboxamide?
The canonical SMILES for N-(2,6-dimethoxyphenyl)-2-methyl-2,3-dihydroindole-1-carboxamide is COc1cccc(OC)c1NC(=O)N1c2ccccc2CC1C.
What is the InChIKey of N-(2,6-dimethoxyphenyl)-2-methyl-2,3-dihydroindole-1-carboxamide?
The InChIKey is RTQUIXGADJPGFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O3/c1-12-11-13-7-4-5-8-14(13)20(12)18(21)19-17-15(22-2)9-6-10-16(17)23-3/h4-10,12H,11H2,1-3H3,(H,19,21).
What are the key properties of N-(2,6-dimethoxyphenyl)-2-methyl-2,3-dihydroindole-1-carboxamide?
N-(2,6-dimethoxyphenyl)-2-methyl-2,3-dihydroindole-1-carboxamide has a molecular weight of 312.37 g/mol, XLogP of 3.69, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethoxyphenyl)-2-methyl-2,3-dihydroindole-1-carboxamide is sourced from PubChem (CID 108868023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).