N-(2,4-difluorophenyl)-3-indol-1-ylpropanamide

C17H14F2N2O — CID 9209396

IUPACN-(2,4-difluorophenyl)-3-indol-1-ylpropanamide
SMILESO=C(CCn1ccc2ccccc21)Nc1ccc(F)cc1F
InChIInChI=1S/C17H14F2N2O/c18-13-5-6-15(14(19)11-13)20-17(22)8-10-21-9-7-12-3-1-2-4-16(12)21/h1-7,9,11H,8,10H2,(H,20,22)
InChIKeyBHYSEFALQIDYBO-UHFFFAOYSA-N
MW300.31 g/mol
LogP3.95
Rot. Bonds4

About N-(2,4-difluorophenyl)-3-indol-1-ylpropanamide

N-(2,4-difluorophenyl)-3-indol-1-ylpropanamide (PubChem CID 9209396) has the molecular formula C17H14F2N2O and a molecular weight of 300.31 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)-3-indol-1-ylpropanamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-3-indol-1-ylpropanamide
PubChem CID9209396
Molecular FormulaC17H14F2N2O
Molecular Weight300.31 g/mol
Exact Mass300.11
IUPAC NameN-(2,4-difluorophenyl)-3-indol-1-ylpropanamide
SMILESO=C(CCn1ccc2ccccc21)Nc1ccc(F)cc1F
InChIInChI=1S/C17H14F2N2O/c18-13-5-6-15(14(19)11-13)20-17(22)8-10-21-9-7-12-3-1-2-4-16(12)21/h1-7,9,11H,8,10H2,(H,20,22)
InChIKeyBHYSEFALQIDYBO-UHFFFAOYSA-N
XLogP3.95
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.31
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-amino-5-fluorophenyl)-2-indol-1-ylacetamide
CID 43611958
N-[5-chloro-2-(dimethylamino)phenyl]-3-indol-1-ylpropanamide
CID 56532124
N-(4-aminophenyl)-3-indol-1-ylpropanamide
CID 43247263
N-(2-amino-4-fluorophenyl)-3-(2-oxo-1-pyridinyl)propanamide
CID 16788694
N-[4-(3,5-dimethylpyrazol-1-yl)-3-fluorophenyl]-3-indol-1-ylpropanamide
CID 55950802
N-(2,4-difluorophenyl)-2-naphthalen-1-ylsulfanylacetamide
CID 39922404
(2-fluorophenyl) 3-indol-1-ylpropanoate
CID 86919496
2-(6-fluoroindol-1-yl)-N-(3-indol-1-ylpropyl)acetamide
CID 166330830
N'-(2,4-difluorophenyl)-N-(4-fluorophenyl)butanediamide
CID 670678
1-[3-(2,4-difluoroanilino)-3-oxopropyl]pyrazole-3-carboxylic acid
CID 19470570
2-[3-(6-fluoroindol-1-yl)propanoylamino]-2-phenylacetic acid
CID 75117707
N-(5-bromonaphthalen-2-yl)-3-indol-1-ylpropanamide
CID 146022047

Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-3-indol-1-ylpropanamide?
The IUPAC name of N-(2,4-difluorophenyl)-3-indol-1-ylpropanamide (CID 9209396) is N-(2,4-difluorophenyl)-3-indol-1-ylpropanamide.
What is the SMILES notation for N-(2,4-difluorophenyl)-3-indol-1-ylpropanamide?
The canonical SMILES for N-(2,4-difluorophenyl)-3-indol-1-ylpropanamide is O=C(CCn1ccc2ccccc21)Nc1ccc(F)cc1F.
What is the InChIKey of N-(2,4-difluorophenyl)-3-indol-1-ylpropanamide?
The InChIKey is BHYSEFALQIDYBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14F2N2O/c18-13-5-6-15(14(19)11-13)20-17(22)8-10-21-9-7-12-3-1-2-4-16(12)21/h1-7,9,11H,8,10H2,(H,20,22).
What are the key properties of N-(2,4-difluorophenyl)-3-indol-1-ylpropanamide?
N-(2,4-difluorophenyl)-3-indol-1-ylpropanamide has a molecular weight of 300.31 g/mol, XLogP of 3.95, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)-3-indol-1-ylpropanamide is sourced from PubChem (CID 9209396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).