(2S)-2-(2,3-dihydroindol-1-yl)-N-(2-fluorophenyl)propanamide

C17H17FN2O — CID 8704291

IUPAC(2S)-2-(2,3-dihydroindol-1-yl)-N-(2-fluorophenyl)propanamide
SMILESC[C@@H](C(=O)Nc1ccccc1F)N1CCc2ccccc21
InChIInChI=1S/C17H17FN2O/c1-12(17(21)19-15-8-4-3-7-14(15)18)20-11-10-13-6-2-5-9-16(13)20/h2-9,12H,10-11H2,1H3,(H,19,21)/t12-/m0/s1
InChIKeyQPNGRHOMKXSTMZ-LBPRGKRZSA-N
MW284.33 g/mol
LogP3.22
Rot. Bonds3

About (2S)-2-(2,3-dihydroindol-1-yl)-N-(2-fluorophenyl)propanamide

(2S)-2-(2,3-dihydroindol-1-yl)-N-(2-fluorophenyl)propanamide (PubChem CID 8704291) has the molecular formula C17H17FN2O and a molecular weight of 284.33 g/mol. Its IUPAC name is (2S)-2-(2,3-dihydroindol-1-yl)-N-(2-fluorophenyl)propanamide.

Molecular Properties

Compound Name(2S)-2-(2,3-dihydroindol-1-yl)-N-(2-fluorophenyl)propanamide
PubChem CID8704291
Molecular FormulaC17H17FN2O
Molecular Weight284.33 g/mol
Exact Mass284.13
IUPAC Name(2S)-2-(2,3-dihydroindol-1-yl)-N-(2-fluorophenyl)propanamide
SMILESC[C@@H](C(=O)Nc1ccccc1F)N1CCc2ccccc21
InChIInChI=1S/C17H17FN2O/c1-12(17(21)19-15-8-4-3-7-14(15)18)20-11-10-13-6-2-5-9-16(13)20/h2-9,12H,10-11H2,1H3,(H,19,21)/t12-/m0/s1
InChIKeyQPNGRHOMKXSTMZ-LBPRGKRZSA-N
XLogP3.22
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.33
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-N-(4-chloro-2-fluorophenyl)-2-(2,3-dihydroindol-1-yl)propanamide
CID 9432138
(2R)-2-(2,3-dihydroindol-1-yl)-N-(4-fluorophenyl)propanamide
CID 8704324
(2R)-N-(2,3-dichlorophenyl)-2-(2,3-dihydroindol-1-yl)propanamide
CID 7940820
N-(3-amino-4-fluorophenyl)-2-(2,3-dihydroindol-1-yl)propanamide
CID 16792940
2-(3,4-dihydro-2H-quinolin-1-yl)-N-(2-propan-2-ylphenyl)propanamide
CID 24506586
N-(5-chloro-2-methoxyphenyl)-2-(2,3-dihydroindol-1-yl)propanamide
CID 4875488
(2S)-2-(2,3-dihydroindol-1-yl)-N-(2,4,6-trimethylphenyl)propanamide
CID 8704347
(2S)-N-[4-(difluoromethylsulfanyl)phenyl]-2-(2,3-dihydroindol-1-yl)propanamide
CID 9432032
(2R)-2-(2,3-dihydroindol-1-yl)-N-[4-(trifluoromethoxy)phenyl]propanamide
CID 7998746
(2R)-N-(3-chloro-2-methylphenyl)-2-(3,4-dihydro-2H-quinolin-1-yl)propanamide
CID 9249760
N-(2-fluorophenyl)-2,3-dihydroindole-1-carboxamide
CID 6468631
(2R)-N-(3-chlorophenyl)-2-(2,3-dihydroindol-1-yl)propanamide
CID 8704432

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(2,3-dihydroindol-1-yl)-N-(2-fluorophenyl)propanamide?
The IUPAC name of (2S)-2-(2,3-dihydroindol-1-yl)-N-(2-fluorophenyl)propanamide (CID 8704291) is (2S)-2-(2,3-dihydroindol-1-yl)-N-(2-fluorophenyl)propanamide.
What is the SMILES notation for (2S)-2-(2,3-dihydroindol-1-yl)-N-(2-fluorophenyl)propanamide?
The canonical SMILES for (2S)-2-(2,3-dihydroindol-1-yl)-N-(2-fluorophenyl)propanamide is C[C@@H](C(=O)Nc1ccccc1F)N1CCc2ccccc21.
What is the InChIKey of (2S)-2-(2,3-dihydroindol-1-yl)-N-(2-fluorophenyl)propanamide?
The InChIKey is QPNGRHOMKXSTMZ-LBPRGKRZSA-N. The full InChI is InChI=1S/C17H17FN2O/c1-12(17(21)19-15-8-4-3-7-14(15)18)20-11-10-13-6-2-5-9-16(13)20/h2-9,12H,10-11H2,1H3,(H,19,21)/t12-/m0/s1.
What are the key properties of (2S)-2-(2,3-dihydroindol-1-yl)-N-(2-fluorophenyl)propanamide?
(2S)-2-(2,3-dihydroindol-1-yl)-N-(2-fluorophenyl)propanamide has a molecular weight of 284.33 g/mol, XLogP of 3.22, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(2,3-dihydroindol-1-yl)-N-(2-fluorophenyl)propanamide is sourced from PubChem (CID 8704291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).