N-(4-acetamidophenyl)-2-(4,6-difluoro-2,3-dihydroindol-1-yl)acetamide

C18H17F2N3O2 — CID 126776606

IUPACN-(4-acetamidophenyl)-2-(4,6-difluoro-2,3-dihydroindol-1-yl)acetamide
SMILESCC(=O)Nc1ccc(NC(=O)CN2CCc3c(F)cc(F)cc32)cc1
InChIInChI=1S/C18H17F2N3O2/c1-11(24)21-13-2-4-14(5-3-13)22-18(25)10-23-7-6-15-16(20)8-12(19)9-17(15)23/h2-5,8-9H,6-7,10H2,1H3,(H,21,24)(H,22,25)
InChIKeyDYRDKEGWCKFVKK-UHFFFAOYSA-N
MW345.35 g/mol
LogP2.92
Rot. Bonds4

About N-(4-acetamidophenyl)-2-(4,6-difluoro-2,3-dihydroindol-1-yl)acetamide

N-(4-acetamidophenyl)-2-(4,6-difluoro-2,3-dihydroindol-1-yl)acetamide (PubChem CID 126776606) has the molecular formula C18H17F2N3O2 and a molecular weight of 345.35 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-2-(4,6-difluoro-2,3-dihydroindol-1-yl)acetamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-2-(4,6-difluoro-2,3-dihydroindol-1-yl)acetamide
PubChem CID126776606
Molecular FormulaC18H17F2N3O2
Molecular Weight345.35 g/mol
Exact Mass345.13
IUPAC NameN-(4-acetamidophenyl)-2-(4,6-difluoro-2,3-dihydroindol-1-yl)acetamide
SMILESCC(=O)Nc1ccc(NC(=O)CN2CCc3c(F)cc(F)cc32)cc1
InChIInChI=1S/C18H17F2N3O2/c1-11(24)21-13-2-4-14(5-3-13)22-18(25)10-23-7-6-15-16(20)8-12(19)9-17(15)23/h2-5,8-9H,6-7,10H2,1H3,(H,21,24)(H,22,25)
InChIKeyDYRDKEGWCKFVKK-UHFFFAOYSA-N
XLogP2.92
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.35
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(5,7-difluoro-3,4-dihydro-2H-quinolin-1-yl)-N-(2,5-difluorophenyl)acetamide
CID 37197085
2-[4-(3-acetamidobenzoyl)piperazin-1-yl]-N-(4-fluorophenyl)acetamide
CID 9021927
N-(4-acetylphenyl)-2-[4-(4-fluorophenyl)piperazin-1-yl]acetamide
CID 1142120
2-[4-(2-acetyl-3-fluorophenyl)piperazin-1-yl]-N-(4-fluorophenyl)acetamide
CID 55431961
N-[4-(2,4,6-trifluorobenzoyl)phenyl]acetamide
CID 65101340
N-(4-acetylphenyl)-2-[4-(2-fluorophenyl)piperazin-1-yl]acetamide;hydrochloride
CID 171668840
N-(4-acetamidophenyl)-2-[4-(5-fluoro-3-pyridinyl)piperazin-1-yl]acetamide
CID 100665806
2-(2,3-dihydroindol-1-yl)-N-(4-methylphenyl)acetamide
CID 2402749
N-(3-acetamido-4-fluorophenyl)-2-piperazin-1-ylacetamide
CID 60928545
N-(4-acetamidophenyl)-2-(4-methylpiperidin-1-yl)acetamide
CID 2697828
N-(4-fluorophenyl)-2-(4-prop-2-enylpiperazin-1-yl)acetamide
CID 8719101
N-(4-acetamidophenyl)-2-(8-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)acetamide
CID 126420480

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-2-(4,6-difluoro-2,3-dihydroindol-1-yl)acetamide?
The IUPAC name of N-(4-acetamidophenyl)-2-(4,6-difluoro-2,3-dihydroindol-1-yl)acetamide (CID 126776606) is N-(4-acetamidophenyl)-2-(4,6-difluoro-2,3-dihydroindol-1-yl)acetamide.
What is the SMILES notation for N-(4-acetamidophenyl)-2-(4,6-difluoro-2,3-dihydroindol-1-yl)acetamide?
The canonical SMILES for N-(4-acetamidophenyl)-2-(4,6-difluoro-2,3-dihydroindol-1-yl)acetamide is CC(=O)Nc1ccc(NC(=O)CN2CCc3c(F)cc(F)cc32)cc1.
What is the InChIKey of N-(4-acetamidophenyl)-2-(4,6-difluoro-2,3-dihydroindol-1-yl)acetamide?
The InChIKey is DYRDKEGWCKFVKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17F2N3O2/c1-11(24)21-13-2-4-14(5-3-13)22-18(25)10-23-7-6-15-16(20)8-12(19)9-17(15)23/h2-5,8-9H,6-7,10H2,1H3,(H,21,24)(H,22,25).
What are the key properties of N-(4-acetamidophenyl)-2-(4,6-difluoro-2,3-dihydroindol-1-yl)acetamide?
N-(4-acetamidophenyl)-2-(4,6-difluoro-2,3-dihydroindol-1-yl)acetamide has a molecular weight of 345.35 g/mol, XLogP of 2.92, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-2-(4,6-difluoro-2,3-dihydroindol-1-yl)acetamide is sourced from PubChem (CID 126776606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).