N-[[4-[(1S)-1-hydroxyethyl]phenyl]methyl]-2-(1H-indol-3-yl)acetamide

C19H20N2O2 — CID 95308809

IUPACN-[[4-[(1S)-1-hydroxyethyl]phenyl]methyl]-2-(1H-indol-3-yl)acetamide
SMILESC[C@H](O)c1ccc(CNC(=O)Cc2c[nH]c3ccccc23)cc1
InChIInChI=1S/C19H20N2O2/c1-13(22)15-8-6-14(7-9-15)11-21-19(23)10-16-12-20-18-5-3-2-4-17(16)18/h2-9,12-13,20,22H,10-11H2,1H3,(H,21,23)/t13-/m0/s1
InChIKeyQHHTTWHQSQBVPJ-ZDUSSCGKSA-N
MW308.38 g/mol
LogP3.08
Rot. Bonds5

About N-[[4-[(1S)-1-hydroxyethyl]phenyl]methyl]-2-(1H-indol-3-yl)acetamide

N-[[4-[(1S)-1-hydroxyethyl]phenyl]methyl]-2-(1H-indol-3-yl)acetamide (PubChem CID 95308809) has the molecular formula C19H20N2O2 and a molecular weight of 308.38 g/mol. Its IUPAC name is N-[[4-[(1S)-1-hydroxyethyl]phenyl]methyl]-2-(1H-indol-3-yl)acetamide.

Molecular Properties

Compound NameN-[[4-[(1S)-1-hydroxyethyl]phenyl]methyl]-2-(1H-indol-3-yl)acetamide
PubChem CID95308809
Molecular FormulaC19H20N2O2
Molecular Weight308.38 g/mol
Exact Mass308.15
IUPAC NameN-[[4-[(1S)-1-hydroxyethyl]phenyl]methyl]-2-(1H-indol-3-yl)acetamide
SMILESC[C@H](O)c1ccc(CNC(=O)Cc2c[nH]c3ccccc23)cc1
InChIInChI=1S/C19H20N2O2/c1-13(22)15-8-6-14(7-9-15)11-21-19(23)10-16-12-20-18-5-3-2-4-17(16)18/h2-9,12-13,20,22H,10-11H2,1H3,(H,21,23)/t13-/m0/s1
InChIKeyQHHTTWHQSQBVPJ-ZDUSSCGKSA-N
XLogP3.08
TPSA65.12 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 53.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Analyze N-[[4-[(1S)-1-hydroxyethyl]phenyl]methyl]-2-(1H-indol-3-yl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(2S)-2-hydroxypropyl]-2-(1H-indol-3-yl)acetamide
CID 39248120
N-but-3-yn-2-yl-2-(1H-indol-3-yl)acetamide
CID 114389821
N-(1H-indol-3-ylmethyl)-2-(4-methoxyphenyl)acetamide
CID 110357464
2-[[[2-(1H-indol-3-yl)acetyl]amino]methyl]-4-methylpentanoic acid
CID 119253373
N-[2-(4-hydroxyphenyl)ethyl]-2-(1H-indol-3-yl)acetamide
CID 7097288
N-hydroxy-2-(1H-indol-3-yl)acetamide
CID 13058633
2-(1H-indol-3-yl)-N-[(1S)-1-naphthalen-2-ylethyl]acetamide
CID 40810685
N-but-2-ynyl-2-(1H-indol-3-yl)acetamide;ethane
CID 143542035
N-[2-(4-chlorophenyl)ethyl]-2-(1H-indol-3-yl)acetamide
CID 2114473
(2S,3S)-3-hydroxy-2-[[2-(1H-indol-3-yl)acetyl]amino]butanoate
CID 7678364
N-(4,4-diphenylbutyl)-2-(1H-indol-3-yl)acetamide
CID 178070448
N-[(1R)-1,2-bis(4-methoxyphenyl)ethyl]-2-(1H-indol-3-yl)acetamide
CID 9451408

Frequently Asked Questions

What is the IUPAC name of N-[[4-[(1S)-1-hydroxyethyl]phenyl]methyl]-2-(1H-indol-3-yl)acetamide?
The IUPAC name of N-[[4-[(1S)-1-hydroxyethyl]phenyl]methyl]-2-(1H-indol-3-yl)acetamide (CID 95308809) is N-[[4-[(1S)-1-hydroxyethyl]phenyl]methyl]-2-(1H-indol-3-yl)acetamide.
What is the SMILES notation for N-[[4-[(1S)-1-hydroxyethyl]phenyl]methyl]-2-(1H-indol-3-yl)acetamide?
The canonical SMILES for N-[[4-[(1S)-1-hydroxyethyl]phenyl]methyl]-2-(1H-indol-3-yl)acetamide is C[C@H](O)c1ccc(CNC(=O)Cc2c[nH]c3ccccc23)cc1.
What is the InChIKey of N-[[4-[(1S)-1-hydroxyethyl]phenyl]methyl]-2-(1H-indol-3-yl)acetamide?
The InChIKey is QHHTTWHQSQBVPJ-ZDUSSCGKSA-N. The full InChI is InChI=1S/C19H20N2O2/c1-13(22)15-8-6-14(7-9-15)11-21-19(23)10-16-12-20-18-5-3-2-4-17(16)18/h2-9,12-13,20,22H,10-11H2,1H3,(H,21,23)/t13-/m0/s1.
What are the key properties of N-[[4-[(1S)-1-hydroxyethyl]phenyl]methyl]-2-(1H-indol-3-yl)acetamide?
N-[[4-[(1S)-1-hydroxyethyl]phenyl]methyl]-2-(1H-indol-3-yl)acetamide has a molecular weight of 308.38 g/mol, XLogP of 3.08, 5 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-[(1S)-1-hydroxyethyl]phenyl]methyl]-2-(1H-indol-3-yl)acetamide is sourced from PubChem (CID 95308809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).