2-chloro-N-(1-ethyl-2-oxo-3H-indol-5-yl)benzamide

C17H15ClN2O2 — CID 27639248

IUPAC2-chloro-N-(1-ethyl-2-oxo-3H-indol-5-yl)benzamide
SMILESCCN1C(=O)Cc2cc(NC(=O)c3ccccc3Cl)ccc21
InChIInChI=1S/C17H15ClN2O2/c1-2-20-15-8-7-12(9-11(15)10-16(20)21)19-17(22)13-5-3-4-6-14(13)18/h3-9H,2,10H2,1H3,(H,19,22)
InChIKeyBRVZNZUIVURMLC-UHFFFAOYSA-N
MW314.77 g/mol
LogP3.50
Rot. Bonds3

About 2-chloro-N-(1-ethyl-2-oxo-3H-indol-5-yl)benzamide

2-chloro-N-(1-ethyl-2-oxo-3H-indol-5-yl)benzamide (PubChem CID 27639248) has the molecular formula C17H15ClN2O2 and a molecular weight of 314.77 g/mol. Its IUPAC name is 2-chloro-N-(1-ethyl-2-oxo-3H-indol-5-yl)benzamide.

Molecular Properties

Compound Name2-chloro-N-(1-ethyl-2-oxo-3H-indol-5-yl)benzamide
PubChem CID27639248
Molecular FormulaC17H15ClN2O2
Molecular Weight314.77 g/mol
Exact Mass314.08
IUPAC Name2-chloro-N-(1-ethyl-2-oxo-3H-indol-5-yl)benzamide
SMILESCCN1C(=O)Cc2cc(NC(=O)c3ccccc3Cl)ccc21
InChIInChI=1S/C17H15ClN2O2/c1-2-20-15-8-7-12(9-11(15)10-16(20)21)19-17(22)13-5-3-4-6-14(13)18/h3-9H,2,10H2,1H3,(H,19,22)
InChIKeyBRVZNZUIVURMLC-UHFFFAOYSA-N
XLogP3.50
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.77
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-ethyl-2-oxo-3H-indol-5-yl)acetamide
CID 20933157
2-chloro-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)benzamide
CID 27421932
1-(2-chlorophenyl)-N-(1-ethyl-2-oxo-3H-indol-5-yl)methanesulfonamide
CID 41342474
1-[(4-chlorophenyl)methyl]-3-(1-ethyl-2-oxo-3H-indol-5-yl)urea
CID 30375770
1-ethyl-5-(methylamino)-3H-indol-2-one
CID 82551072
1-(1-ethyl-2-oxo-3H-indol-5-yl)-3-thiophen-2-ylurea
CID 30375764
2-chloro-N-(1-methylsulfonyl-2,3-dihydroindol-5-yl)benzamide
CID 112506182
1-(1-ethyl-2-oxo-3H-indol-5-yl)-3-(naphthalen-1-ylmethyl)urea
CID 30375844
N-[3-amino-4-(4-ethylpiperazin-1-yl)phenyl]-2-chlorobenzamide
CID 91676128
1-(4-butoxyphenyl)-3-(1-ethyl-2-oxo-3H-indol-5-yl)urea
CID 30375820
2-chloro-N-(1-ethyl-3-oxo-2,1-benzothiazol-5-yl)benzamide
CID 56933576
N-(1-ethyl-2-oxo-3H-indol-5-yl)-3-(4-methylsulfonylphenyl)propanamide
CID 91624454

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(1-ethyl-2-oxo-3H-indol-5-yl)benzamide?
The IUPAC name of 2-chloro-N-(1-ethyl-2-oxo-3H-indol-5-yl)benzamide (CID 27639248) is 2-chloro-N-(1-ethyl-2-oxo-3H-indol-5-yl)benzamide.
What is the SMILES notation for 2-chloro-N-(1-ethyl-2-oxo-3H-indol-5-yl)benzamide?
The canonical SMILES for 2-chloro-N-(1-ethyl-2-oxo-3H-indol-5-yl)benzamide is CCN1C(=O)Cc2cc(NC(=O)c3ccccc3Cl)ccc21.
What is the InChIKey of 2-chloro-N-(1-ethyl-2-oxo-3H-indol-5-yl)benzamide?
The InChIKey is BRVZNZUIVURMLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15ClN2O2/c1-2-20-15-8-7-12(9-11(15)10-16(20)21)19-17(22)13-5-3-4-6-14(13)18/h3-9H,2,10H2,1H3,(H,19,22).
What are the key properties of 2-chloro-N-(1-ethyl-2-oxo-3H-indol-5-yl)benzamide?
2-chloro-N-(1-ethyl-2-oxo-3H-indol-5-yl)benzamide has a molecular weight of 314.77 g/mol, XLogP of 3.50, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(1-ethyl-2-oxo-3H-indol-5-yl)benzamide is sourced from PubChem (CID 27639248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).