[5-(2,5-dichloroanilino)-3-pyridinyl]-(2,3-dihydroindol-1-yl)methanone

C20H15Cl2N3O — CID 109242444

IUPAC[5-(2,5-dichloroanilino)-3-pyridinyl]-(2,3-dihydroindol-1-yl)methanone
SMILESO=C(c1cncc(Nc2cc(Cl)ccc2Cl)c1)N1CCc2ccccc21
InChIInChI=1S/C20H15Cl2N3O/c21-15-5-6-17(22)18(10-15)24-16-9-14(11-23-12-16)20(26)25-8-7-13-3-1-2-4-19(13)25/h1-6,9-12,24H,7-8H2
InChIKeySUWBNZSMTIGIHK-UHFFFAOYSA-N
MW384.27 g/mol
LogP5.33
Rot. Bonds3

About [5-(2,5-dichloroanilino)-3-pyridinyl]-(2,3-dihydroindol-1-yl)methanone

[5-(2,5-dichloroanilino)-3-pyridinyl]-(2,3-dihydroindol-1-yl)methanone (PubChem CID 109242444) has the molecular formula C20H15Cl2N3O and a molecular weight of 384.27 g/mol. Its IUPAC name is [5-(2,5-dichloroanilino)-3-pyridinyl]-(2,3-dihydroindol-1-yl)methanone.

Molecular Properties

Compound Name[5-(2,5-dichloroanilino)-3-pyridinyl]-(2,3-dihydroindol-1-yl)methanone
PubChem CID109242444
Molecular FormulaC20H15Cl2N3O
Molecular Weight384.27 g/mol
Exact Mass383.06
IUPAC Name[5-(2,5-dichloroanilino)-3-pyridinyl]-(2,3-dihydroindol-1-yl)methanone
SMILESO=C(c1cncc(Nc2cc(Cl)ccc2Cl)c1)N1CCc2ccccc21
InChIInChI=1S/C20H15Cl2N3O/c21-15-5-6-17(22)18(10-15)24-16-9-14(11-23-12-16)20(26)25-8-7-13-3-1-2-4-19(13)25/h1-6,9-12,24H,7-8H2
InChIKeySUWBNZSMTIGIHK-UHFFFAOYSA-N
XLogP5.33
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500384.27
LogP ≤ 55.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[5-(3-chloroanilino)-3-pyridinyl]-(3,4-dihydro-2H-quinolin-1-yl)methanone
CID 109242554
2,3-dihydroindol-1-yl-[5-(2,3-dimethylanilino)-3-pyridinyl]methanone
CID 109242383
2,3-dihydroindol-1-yl-[5-(3,5-dimethylanilino)-3-pyridinyl]methanone
CID 109242381
N-(4-chlorophenyl)-5-(2,3-dihydroindole-1-carbonyl)pyridine-3-carboxamide
CID 109108143
[5-(cyclopropylamino)-3-pyridinyl]-(2,3-dihydroindol-1-yl)methanone
CID 109223844
3,4-dihydro-2H-quinolin-1-yl-[5-(2,3-dimethylanilino)-3-pyridinyl]methanone
CID 109242545
[5-(butan-2-ylamino)-3-pyridinyl]-(2,3-dihydroindol-1-yl)methanone
CID 109225396
N-(2,5-dichlorophenyl)-5-(2,3-dihydroindol-1-yl)pyridine-3-carboxamide
CID 109242525
2,3-dihydroindol-1-yl-[5-(pyridin-4-ylmethylamino)-3-pyridinyl]methanone
CID 109235678
N-(3-chloro-2-methylphenyl)-5-(2,3-dihydroindole-1-carbonyl)pyridine-3-carboxamide
CID 109108144
2,3-dihydroindol-1-yl-[5-(pentylamino)-3-pyridinyl]methanone
CID 109240141
2,3-dihydroindol-1-yl-[5-(2-methoxyethylamino)-3-pyridinyl]methanone
CID 109227903

Frequently Asked Questions

What is the IUPAC name of [5-(2,5-dichloroanilino)-3-pyridinyl]-(2,3-dihydroindol-1-yl)methanone?
The IUPAC name of [5-(2,5-dichloroanilino)-3-pyridinyl]-(2,3-dihydroindol-1-yl)methanone (CID 109242444) is [5-(2,5-dichloroanilino)-3-pyridinyl]-(2,3-dihydroindol-1-yl)methanone.
What is the SMILES notation for [5-(2,5-dichloroanilino)-3-pyridinyl]-(2,3-dihydroindol-1-yl)methanone?
The canonical SMILES for [5-(2,5-dichloroanilino)-3-pyridinyl]-(2,3-dihydroindol-1-yl)methanone is O=C(c1cncc(Nc2cc(Cl)ccc2Cl)c1)N1CCc2ccccc21.
What is the InChIKey of [5-(2,5-dichloroanilino)-3-pyridinyl]-(2,3-dihydroindol-1-yl)methanone?
The InChIKey is SUWBNZSMTIGIHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15Cl2N3O/c21-15-5-6-17(22)18(10-15)24-16-9-14(11-23-12-16)20(26)25-8-7-13-3-1-2-4-19(13)25/h1-6,9-12,24H,7-8H2.
What are the key properties of [5-(2,5-dichloroanilino)-3-pyridinyl]-(2,3-dihydroindol-1-yl)methanone?
[5-(2,5-dichloroanilino)-3-pyridinyl]-(2,3-dihydroindol-1-yl)methanone has a molecular weight of 384.27 g/mol, XLogP of 5.33, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(2,5-dichloroanilino)-3-pyridinyl]-(2,3-dihydroindol-1-yl)methanone is sourced from PubChem (CID 109242444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).