N-(2,6-difluorophenyl)-2-[2,3-dihydro-1H-indol-7-ylmethyl(ethyl)amino]acetamide

C19H21F2N3O — CID 120847730

IUPACN-(2,6-difluorophenyl)-2-[2,3-dihydro-1H-indol-7-ylmethyl(ethyl)amino]acetamide
SMILESCCN(CC(=O)Nc1c(F)cccc1F)Cc1cccc2c1NCC2
InChIInChI=1S/C19H21F2N3O/c1-2-24(11-14-6-3-5-13-9-10-22-18(13)14)12-17(25)23-19-15(20)7-4-8-16(19)21/h3-8,22H,2,9-12H2,1H3,(H,23,25)
InChIKeyKOODAILTBHBDBW-UHFFFAOYSA-N
MW345.39 g/mol
LogP3.39
Rot. Bonds6

About N-(2,6-difluorophenyl)-2-[2,3-dihydro-1H-indol-7-ylmethyl(ethyl)amino]acetamide

N-(2,6-difluorophenyl)-2-[2,3-dihydro-1H-indol-7-ylmethyl(ethyl)amino]acetamide (PubChem CID 120847730) has the molecular formula C19H21F2N3O and a molecular weight of 345.39 g/mol. Its IUPAC name is N-(2,6-difluorophenyl)-2-[2,3-dihydro-1H-indol-7-ylmethyl(ethyl)amino]acetamide.

Molecular Properties

Compound NameN-(2,6-difluorophenyl)-2-[2,3-dihydro-1H-indol-7-ylmethyl(ethyl)amino]acetamide
PubChem CID120847730
Molecular FormulaC19H21F2N3O
Molecular Weight345.39 g/mol
Exact Mass345.17
IUPAC NameN-(2,6-difluorophenyl)-2-[2,3-dihydro-1H-indol-7-ylmethyl(ethyl)amino]acetamide
SMILESCCN(CC(=O)Nc1c(F)cccc1F)Cc1cccc2c1NCC2
InChIInChI=1S/C19H21F2N3O/c1-2-24(11-14-6-3-5-13-9-10-22-18(13)14)12-17(25)23-19-15(20)7-4-8-16(19)21/h3-8,22H,2,9-12H2,1H3,(H,23,25)
InChIKeyKOODAILTBHBDBW-UHFFFAOYSA-N
XLogP3.39
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.39
LogP ≤ 53.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2,3-dihydro-1H-indol-7-ylmethyl(ethyl)amino]-N-[2-(trifluoromethyl)phenyl]acetamide;hydrochloride
CID 120847394
N-(2,6-dichlorophenyl)-2-[2,3-dihydro-1H-indol-7-ylmethyl(methyl)amino]acetamide;hydrochloride
CID 120847429
N-(2,6-difluorophenyl)-2-[ethyl(2-hydroxyethyl)amino]acetamide
CID 60685460
4-[[2,3-dihydro-1H-indol-7-ylmethyl(ethyl)amino]methyl]-N,N-dimethylbenzamide
CID 120848272
N-(2,6-difluorophenyl)-2-[ethyl(thiophen-2-ylmethyl)amino]acetamide
CID 8718062
N-(2-bromophenyl)-2-[2,3-dihydro-1H-indol-7-ylmethyl(methyl)amino]acetamide
CID 120847738
N-(2,3-dihydro-1H-indol-7-ylmethyl)-N-ethyl-2-methylbutan-1-amine
CID 114327291
2-[[2-(2,6-difluoroanilino)-2-oxoethyl]-methylamino]-N-(4-fluorophenyl)acetamide
CID 9253301
2-(2,3-dihydro-1H-indol-7-yl)-N-methylacetamide
CID 115105290
ethane;7-fluoro-2,3-dihydro-1H-indole
CID 171527172
N-(2,6-difluorophenyl)-2-[(4-fluorophenyl)methyl-methylamino]acetamide
CID 2451655
N-(2,3-dihydro-1H-indol-7-ylmethyl)-N',N'-diethylethane-1,2-diamine
CID 80650079

Frequently Asked Questions

What is the IUPAC name of N-(2,6-difluorophenyl)-2-[2,3-dihydro-1H-indol-7-ylmethyl(ethyl)amino]acetamide?
The IUPAC name of N-(2,6-difluorophenyl)-2-[2,3-dihydro-1H-indol-7-ylmethyl(ethyl)amino]acetamide (CID 120847730) is N-(2,6-difluorophenyl)-2-[2,3-dihydro-1H-indol-7-ylmethyl(ethyl)amino]acetamide.
What is the SMILES notation for N-(2,6-difluorophenyl)-2-[2,3-dihydro-1H-indol-7-ylmethyl(ethyl)amino]acetamide?
The canonical SMILES for N-(2,6-difluorophenyl)-2-[2,3-dihydro-1H-indol-7-ylmethyl(ethyl)amino]acetamide is CCN(CC(=O)Nc1c(F)cccc1F)Cc1cccc2c1NCC2.
What is the InChIKey of N-(2,6-difluorophenyl)-2-[2,3-dihydro-1H-indol-7-ylmethyl(ethyl)amino]acetamide?
The InChIKey is KOODAILTBHBDBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21F2N3O/c1-2-24(11-14-6-3-5-13-9-10-22-18(13)14)12-17(25)23-19-15(20)7-4-8-16(19)21/h3-8,22H,2,9-12H2,1H3,(H,23,25).
What are the key properties of N-(2,6-difluorophenyl)-2-[2,3-dihydro-1H-indol-7-ylmethyl(ethyl)amino]acetamide?
N-(2,6-difluorophenyl)-2-[2,3-dihydro-1H-indol-7-ylmethyl(ethyl)amino]acetamide has a molecular weight of 345.39 g/mol, XLogP of 3.39, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-difluorophenyl)-2-[2,3-dihydro-1H-indol-7-ylmethyl(ethyl)amino]acetamide is sourced from PubChem (CID 120847730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).