2-(2-chlorophenyl)-N-(1H-indol-3-ylmethyl)acetamide

C17H15ClN2O — CID 110673257

IUPAC2-(2-chlorophenyl)-N-(1H-indol-3-ylmethyl)acetamide
SMILESO=C(Cc1ccccc1Cl)NCc1c[nH]c2ccccc12
InChIInChI=1S/C17H15ClN2O/c18-15-7-3-1-5-12(15)9-17(21)20-11-13-10-19-16-8-4-2-6-14(13)16/h1-8,10,19H,9,11H2,(H,20,21)
InChIKeyBAQFGDWJTGRWJG-UHFFFAOYSA-N
MW298.77 g/mol
LogP3.68
Rot. Bonds4

About 2-(2-chlorophenyl)-N-(1H-indol-3-ylmethyl)acetamide

2-(2-chlorophenyl)-N-(1H-indol-3-ylmethyl)acetamide (PubChem CID 110673257) has the molecular formula C17H15ClN2O and a molecular weight of 298.77 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-N-(1H-indol-3-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(2-chlorophenyl)-N-(1H-indol-3-ylmethyl)acetamide
PubChem CID110673257
Molecular FormulaC17H15ClN2O
Molecular Weight298.77 g/mol
Exact Mass298.09
IUPAC Name2-(2-chlorophenyl)-N-(1H-indol-3-ylmethyl)acetamide
SMILESO=C(Cc1ccccc1Cl)NCc1c[nH]c2ccccc12
InChIInChI=1S/C17H15ClN2O/c18-15-7-3-1-5-12(15)9-17(21)20-11-13-10-19-16-8-4-2-6-14(13)16/h1-8,10,19H,9,11H2,(H,20,21)
InChIKeyBAQFGDWJTGRWJG-UHFFFAOYSA-N
XLogP3.68
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.77
LogP ≤ 53.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(2-fluorophenyl)methyl]-2-(1H-indol-3-yl)acetamide
CID 3562962
N-(1H-indol-3-ylmethyl)pyridine-2-carboxamide
CID 110673234
N-[2-(2-chlorophenoxy)ethyl]-2-(1H-indol-3-yl)acetamide
CID 86069599
2-(1H-indol-3-yl)-N-[[2-(trifluoromethyl)phenyl]methyl]acetamide
CID 20969118
N-(1H-indol-3-ylmethyl)-2-(4-methoxyphenyl)acetamide
CID 110357464
N-[(2-chlorophenyl)methyl]-3-(1H-indol-3-yl)prop-2-enamide
CID 73338848
2-acetamido-2-bromo-N-[(2-chlorophenyl)methyl]-3-(1H-indol-3-yl)propanamide
CID 67700312
N-hydroxy-2-(1H-indol-3-yl)acetamide
CID 13058633
[1-[(2-chlorophenyl)methylamino]-1-oxopropan-2-yl] 3-(1H-indol-3-yl)propanoate
CID 55418939
N-[2-(4-chlorophenyl)ethyl]-2-(1H-indol-3-yl)acetamide
CID 2114473
N-[(2S)-2-hydroxypropyl]-2-(1H-indol-3-yl)acetamide
CID 39248120
N-[2-(1H-indol-3-yl)ethyl]-2-naphthalen-1-ylacetamide
CID 20969018

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-N-(1H-indol-3-ylmethyl)acetamide?
The IUPAC name of 2-(2-chlorophenyl)-N-(1H-indol-3-ylmethyl)acetamide (CID 110673257) is 2-(2-chlorophenyl)-N-(1H-indol-3-ylmethyl)acetamide.
What is the SMILES notation for 2-(2-chlorophenyl)-N-(1H-indol-3-ylmethyl)acetamide?
The canonical SMILES for 2-(2-chlorophenyl)-N-(1H-indol-3-ylmethyl)acetamide is O=C(Cc1ccccc1Cl)NCc1c[nH]c2ccccc12.
What is the InChIKey of 2-(2-chlorophenyl)-N-(1H-indol-3-ylmethyl)acetamide?
The InChIKey is BAQFGDWJTGRWJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15ClN2O/c18-15-7-3-1-5-12(15)9-17(21)20-11-13-10-19-16-8-4-2-6-14(13)16/h1-8,10,19H,9,11H2,(H,20,21).
What are the key properties of 2-(2-chlorophenyl)-N-(1H-indol-3-ylmethyl)acetamide?
2-(2-chlorophenyl)-N-(1H-indol-3-ylmethyl)acetamide has a molecular weight of 298.77 g/mol, XLogP of 3.68, 4 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-N-(1H-indol-3-ylmethyl)acetamide is sourced from PubChem (CID 110673257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).