N-(1-acetyl-2,3-dihydroindol-6-yl)-3-(4-fluorophenyl)hexanamide

C22H25FN2O2 — CID 110354245

IUPACN-(1-acetyl-2,3-dihydroindol-6-yl)-3-(4-fluorophenyl)hexanamide
SMILESCCCC(CC(=O)Nc1ccc2c(c1)N(C(C)=O)CC2)c1ccc(F)cc1
InChIInChI=1S/C22H25FN2O2/c1-3-4-18(16-5-8-19(23)9-6-16)13-22(27)24-20-10-7-17-11-12-25(15(2)26)21(17)14-20/h5-10,14,18H,3-4,11-13H2,1-2H3,(H,24,27)
InChIKeyFNEOGGOUGVTCGF-UHFFFAOYSA-N
MW368.45 g/mol
LogP4.65
Rot. Bonds6

About N-(1-acetyl-2,3-dihydroindol-6-yl)-3-(4-fluorophenyl)hexanamide

N-(1-acetyl-2,3-dihydroindol-6-yl)-3-(4-fluorophenyl)hexanamide (PubChem CID 110354245) has the molecular formula C22H25FN2O2 and a molecular weight of 368.45 g/mol. Its IUPAC name is N-(1-acetyl-2,3-dihydroindol-6-yl)-3-(4-fluorophenyl)hexanamide.

Molecular Properties

Compound NameN-(1-acetyl-2,3-dihydroindol-6-yl)-3-(4-fluorophenyl)hexanamide
PubChem CID110354245
Molecular FormulaC22H25FN2O2
Molecular Weight368.45 g/mol
Exact Mass368.19
IUPAC NameN-(1-acetyl-2,3-dihydroindol-6-yl)-3-(4-fluorophenyl)hexanamide
SMILESCCCC(CC(=O)Nc1ccc2c(c1)N(C(C)=O)CC2)c1ccc(F)cc1
InChIInChI=1S/C22H25FN2O2/c1-3-4-18(16-5-8-19(23)9-6-16)13-22(27)24-20-10-7-17-11-12-25(15(2)26)21(17)14-20/h5-10,14,18H,3-4,11-13H2,1-2H3,(H,24,27)
InChIKeyFNEOGGOUGVTCGF-UHFFFAOYSA-N
XLogP4.65
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.45
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-acetyl-3,4-dihydro-2H-quinolin-7-yl)-2-(3-fluorophenyl)acetamide
CID 50832530
N-[1-(cyclopropanecarbonyl)-2,3-dihydroindol-5-yl]-3-(4-fluorophenyl)butanamide
CID 110312996
N-(1-acetyl-2,3-dihydroindol-5-yl)pentanamide
CID 39952141
(2S)-N-(1-acetyl-2,3-dihydroindol-5-yl)-2-aminopentanamide
CID 107568450
N-(1-ethyl-2,3-dihydroindol-6-yl)-2-(4-fluorophenoxy)acetamide
CID 166188945
1-[6-(propylsulfamoylamino)-2,3-dihydroindol-1-yl]ethanone
CID 110627257
N-(1-acetyl-2,3-dihydroindol-6-yl)-2-(4-morpholin-4-ylphenyl)acetamide
CID 110627232
N'-(1-acetyl-3,4-dihydro-2H-quinolin-7-yl)-N-(3-fluorophenyl)oxamide
CID 7586378
3-methyl-N-(1-propanoyl-3,4-dihydro-2H-quinolin-7-yl)butanamide
CID 27604546
N-(1-acetyl-2,3-dihydroindol-5-yl)-2-[4-(4-fluorobenzoyl)phenoxy]acetamide
CID 18206710
N-(1-acetyl-2,3-dihydroindol-5-yl)-2-(4-acetyl-2-fluorophenyl)sulfanylacetamide
CID 34184863
N-(1-acetyl-2,3-dihydroindol-5-yl)-2-bromoacetamide
CID 63679851

Frequently Asked Questions

What is the IUPAC name of N-(1-acetyl-2,3-dihydroindol-6-yl)-3-(4-fluorophenyl)hexanamide?
The IUPAC name of N-(1-acetyl-2,3-dihydroindol-6-yl)-3-(4-fluorophenyl)hexanamide (CID 110354245) is N-(1-acetyl-2,3-dihydroindol-6-yl)-3-(4-fluorophenyl)hexanamide.
What is the SMILES notation for N-(1-acetyl-2,3-dihydroindol-6-yl)-3-(4-fluorophenyl)hexanamide?
The canonical SMILES for N-(1-acetyl-2,3-dihydroindol-6-yl)-3-(4-fluorophenyl)hexanamide is CCCC(CC(=O)Nc1ccc2c(c1)N(C(C)=O)CC2)c1ccc(F)cc1.
What is the InChIKey of N-(1-acetyl-2,3-dihydroindol-6-yl)-3-(4-fluorophenyl)hexanamide?
The InChIKey is FNEOGGOUGVTCGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25FN2O2/c1-3-4-18(16-5-8-19(23)9-6-16)13-22(27)24-20-10-7-17-11-12-25(15(2)26)21(17)14-20/h5-10,14,18H,3-4,11-13H2,1-2H3,(H,24,27).
What are the key properties of N-(1-acetyl-2,3-dihydroindol-6-yl)-3-(4-fluorophenyl)hexanamide?
N-(1-acetyl-2,3-dihydroindol-6-yl)-3-(4-fluorophenyl)hexanamide has a molecular weight of 368.45 g/mol, XLogP of 4.65, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-acetyl-2,3-dihydroindol-6-yl)-3-(4-fluorophenyl)hexanamide is sourced from PubChem (CID 110354245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).