2-(5-chloroindol-1-yl)-N-pyridin-3-ylacetamide

C15H12ClN3O — CID 39341577

IUPAC2-(5-chloroindol-1-yl)-N-pyridin-3-ylacetamide
SMILESO=C(Cn1ccc2cc(Cl)ccc21)Nc1cccnc1
InChIInChI=1S/C15H12ClN3O/c16-12-3-4-14-11(8-12)5-7-19(14)10-15(20)18-13-2-1-6-17-9-13/h1-9H,10H2,(H,18,20)
InChIKeyUVPOCDPKTOMUFA-UHFFFAOYSA-N
MW285.73 g/mol
LogP3.33
Rot. Bonds3

About 2-(5-chloroindol-1-yl)-N-pyridin-3-ylacetamide

2-(5-chloroindol-1-yl)-N-pyridin-3-ylacetamide (PubChem CID 39341577) has the molecular formula C15H12ClN3O and a molecular weight of 285.73 g/mol. Its IUPAC name is 2-(5-chloroindol-1-yl)-N-pyridin-3-ylacetamide.

Molecular Properties

Compound Name2-(5-chloroindol-1-yl)-N-pyridin-3-ylacetamide
PubChem CID39341577
Molecular FormulaC15H12ClN3O
Molecular Weight285.73 g/mol
Exact Mass285.07
IUPAC Name2-(5-chloroindol-1-yl)-N-pyridin-3-ylacetamide
SMILESO=C(Cn1ccc2cc(Cl)ccc21)Nc1cccnc1
InChIInChI=1S/C15H12ClN3O/c16-12-3-4-14-11(8-12)5-7-19(14)10-15(20)18-13-2-1-6-17-9-13/h1-9H,10H2,(H,18,20)
InChIKeyUVPOCDPKTOMUFA-UHFFFAOYSA-N
XLogP3.33
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.73
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-carbamoyl-2-(5-chloroindol-1-yl)acetamide
CID 116623133
2-[[2-(5-chloroindol-1-yl)acetyl]amino]propanoic acid
CID 53368015
2-(5-chloroindol-1-yl)-N-(2-methylpropyl)acetamide
CID 39349235
2-(6-chloroindol-1-yl)-N-(3-methylphenyl)acetamide
CID 115590570
2-[[2-(5-chloroindol-1-yl)acetyl]amino]-2-phenylacetic acid
CID 53371268
2-(5-chloroindol-1-yl)-N-[(2S)-2-hydroxy-2-phenylethyl]acetamide
CID 39336499
N-(5-chloro-2-pyridinyl)-2-(5-methoxyindol-1-yl)acetamide
CID 29131192
2-(6-chloroindol-1-yl)-N-(4-fluorophenyl)acetamide
CID 115590572
2-(6-bromoindol-1-yl)-N-(3-chlorophenyl)acetamide
CID 116621944
2-(5-bromoindol-1-yl)-N-(2,5-dichlorophenyl)acetamide
CID 4571080
2-(5-chloroindol-1-yl)-N,N-dimethylacetamide
CID 116623166
5-chloro-2-iodo-N-pyridin-3-ylbenzamide
CID 47188812

Frequently Asked Questions

What is the IUPAC name of 2-(5-chloroindol-1-yl)-N-pyridin-3-ylacetamide?
The IUPAC name of 2-(5-chloroindol-1-yl)-N-pyridin-3-ylacetamide (CID 39341577) is 2-(5-chloroindol-1-yl)-N-pyridin-3-ylacetamide.
What is the SMILES notation for 2-(5-chloroindol-1-yl)-N-pyridin-3-ylacetamide?
The canonical SMILES for 2-(5-chloroindol-1-yl)-N-pyridin-3-ylacetamide is O=C(Cn1ccc2cc(Cl)ccc21)Nc1cccnc1.
What is the InChIKey of 2-(5-chloroindol-1-yl)-N-pyridin-3-ylacetamide?
The InChIKey is UVPOCDPKTOMUFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClN3O/c16-12-3-4-14-11(8-12)5-7-19(14)10-15(20)18-13-2-1-6-17-9-13/h1-9H,10H2,(H,18,20).
What are the key properties of 2-(5-chloroindol-1-yl)-N-pyridin-3-ylacetamide?
2-(5-chloroindol-1-yl)-N-pyridin-3-ylacetamide has a molecular weight of 285.73 g/mol, XLogP of 3.33, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chloroindol-1-yl)-N-pyridin-3-ylacetamide is sourced from PubChem (CID 39341577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).