(2S)-N-[2-(2,3-dihydroindol-1-yl)phenyl]-2-ethoxypropanamide

C19H22N2O2 — CID 95667067

IUPAC(2S)-N-[2-(2,3-dihydroindol-1-yl)phenyl]-2-ethoxypropanamide
SMILESCCO[C@@H](C)C(=O)Nc1ccccc1N1CCc2ccccc21
InChIInChI=1S/C19H22N2O2/c1-3-23-14(2)19(22)20-16-9-5-7-11-18(16)21-13-12-15-8-4-6-10-17(15)21/h4-11,14H,3,12-13H2,1-2H3,(H,20,22)/t14-/m0/s1
InChIKeySMAZGSXRPCKQNM-AWEZNQCLSA-N
MW310.40 g/mol
LogP3.74
Rot. Bonds5

About (2S)-N-[2-(2,3-dihydroindol-1-yl)phenyl]-2-ethoxypropanamide

(2S)-N-[2-(2,3-dihydroindol-1-yl)phenyl]-2-ethoxypropanamide (PubChem CID 95667067) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is (2S)-N-[2-(2,3-dihydroindol-1-yl)phenyl]-2-ethoxypropanamide.

Molecular Properties

Compound Name(2S)-N-[2-(2,3-dihydroindol-1-yl)phenyl]-2-ethoxypropanamide
PubChem CID95667067
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC Name(2S)-N-[2-(2,3-dihydroindol-1-yl)phenyl]-2-ethoxypropanamide
SMILESCCO[C@@H](C)C(=O)Nc1ccccc1N1CCc2ccccc21
InChIInChI=1S/C19H22N2O2/c1-3-23-14(2)19(22)20-16-9-5-7-11-18(16)21-13-12-15-8-4-6-10-17(15)21/h4-11,14H,3,12-13H2,1-2H3,(H,20,22)/t14-/m0/s1
InChIKeySMAZGSXRPCKQNM-AWEZNQCLSA-N
XLogP3.74
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[2-(2,3-dihydroindol-1-yl)phenyl]-1-(1-hydroxypropan-2-yl)-1-methylurea
CID 84597316
(2R)-N-[[4-(2,3-dihydroindol-1-ylmethyl)phenyl]methyl]-2-ethoxypropanamide
CID 52608840
N-[2-(2,3-dihydroindol-1-yl)phenyl]-1-ethylsulfonylpiperidine-4-carboxamide
CID 38748916
1-[2-(2,3-dihydroindol-1-yl)phenyl]-3-(3-hydroxypropyl)urea
CID 110891302
(3S)-3-acetamido-N-[2-(2,3-dihydroindol-1-yl)phenyl]-3-(4-methoxyphenyl)propanamide
CID 51725796
N-[2-(2,3-dihydroindol-1-yl)-5-(trifluoromethyl)phenyl]-2-methylpropanamide
CID 175834541
4-[[2-(2,3-dihydroindol-1-yl)phenyl]carbamoylamino]butanoic acid
CID 122075877
N-[2-(2,3-dihydroindol-1-yl)phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide
CID 38748683
N-(2-ethylphenyl)-2,3-dihydroindole-1-carboxamide
CID 6468642
2-ethoxy-N-(2-morpholin-4-ylsulfonylphenyl)propanamide
CID 56801921
2-amino-N-[2-(2,3-dihydroindol-1-ylmethyl)phenyl]pentanamide;dihydrochloride
CID 119853033
6-(2,3-dihydroindol-1-yl)-N-(2-ethylphenyl)pyridine-2-carboxamide
CID 84574320

Frequently Asked Questions

What is the IUPAC name of (2S)-N-[2-(2,3-dihydroindol-1-yl)phenyl]-2-ethoxypropanamide?
The IUPAC name of (2S)-N-[2-(2,3-dihydroindol-1-yl)phenyl]-2-ethoxypropanamide (CID 95667067) is (2S)-N-[2-(2,3-dihydroindol-1-yl)phenyl]-2-ethoxypropanamide.
What is the SMILES notation for (2S)-N-[2-(2,3-dihydroindol-1-yl)phenyl]-2-ethoxypropanamide?
The canonical SMILES for (2S)-N-[2-(2,3-dihydroindol-1-yl)phenyl]-2-ethoxypropanamide is CCO[C@@H](C)C(=O)Nc1ccccc1N1CCc2ccccc21.
What is the InChIKey of (2S)-N-[2-(2,3-dihydroindol-1-yl)phenyl]-2-ethoxypropanamide?
The InChIKey is SMAZGSXRPCKQNM-AWEZNQCLSA-N. The full InChI is InChI=1S/C19H22N2O2/c1-3-23-14(2)19(22)20-16-9-5-7-11-18(16)21-13-12-15-8-4-6-10-17(15)21/h4-11,14H,3,12-13H2,1-2H3,(H,20,22)/t14-/m0/s1.
What are the key properties of (2S)-N-[2-(2,3-dihydroindol-1-yl)phenyl]-2-ethoxypropanamide?
(2S)-N-[2-(2,3-dihydroindol-1-yl)phenyl]-2-ethoxypropanamide has a molecular weight of 310.40 g/mol, XLogP of 3.74, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-[2-(2,3-dihydroindol-1-yl)phenyl]-2-ethoxypropanamide is sourced from PubChem (CID 95667067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).