4,6-dichloro-N-(2,3-dihydro-1H-inden-2-yl)-1H-indole-2-carboxamide

C18H14Cl2N2O — CID 90843687

IUPAC4,6-dichloro-N-(2,3-dihydro-1H-inden-2-yl)-1H-indole-2-carboxamide
SMILESO=C(NC1Cc2ccccc2C1)c1cc2c(Cl)cc(Cl)cc2[nH]1
InChIInChI=1S/C18H14Cl2N2O/c19-12-7-15(20)14-9-17(22-16(14)8-12)18(23)21-13-5-10-3-1-2-4-11(10)6-13/h1-4,7-9,13,22H,5-6H2,(H,21,23)
InChIKeyHVEGQCXFHXQSRH-UHFFFAOYSA-N
MW345.23 g/mol
LogP4.37
Rot. Bonds2

About 4,6-dichloro-N-(2,3-dihydro-1H-inden-2-yl)-1H-indole-2-carboxamide

4,6-dichloro-N-(2,3-dihydro-1H-inden-2-yl)-1H-indole-2-carboxamide (PubChem CID 90843687) has the molecular formula C18H14Cl2N2O and a molecular weight of 345.23 g/mol. Its IUPAC name is 4,6-dichloro-N-(2,3-dihydro-1H-inden-2-yl)-1H-indole-2-carboxamide.

Molecular Properties

Compound Name4,6-dichloro-N-(2,3-dihydro-1H-inden-2-yl)-1H-indole-2-carboxamide
PubChem CID90843687
Molecular FormulaC18H14Cl2N2O
Molecular Weight345.23 g/mol
Exact Mass344.05
IUPAC Name4,6-dichloro-N-(2,3-dihydro-1H-inden-2-yl)-1H-indole-2-carboxamide
SMILESO=C(NC1Cc2ccccc2C1)c1cc2c(Cl)cc(Cl)cc2[nH]1
InChIInChI=1S/C18H14Cl2N2O/c19-12-7-15(20)14-9-17(22-16(14)8-12)18(23)21-13-5-10-3-1-2-4-11(10)6-13/h1-4,7-9,13,22H,5-6H2,(H,21,23)
InChIKeyHVEGQCXFHXQSRH-UHFFFAOYSA-N
XLogP4.37
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.23
LogP ≤ 54.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4,6-dichloro-N-(2,3-dihydro-1H-inden-2-yl)-1H-indole-2-carboxamide?
The IUPAC name of 4,6-dichloro-N-(2,3-dihydro-1H-inden-2-yl)-1H-indole-2-carboxamide (CID 90843687) is 4,6-dichloro-N-(2,3-dihydro-1H-inden-2-yl)-1H-indole-2-carboxamide.
What is the SMILES notation for 4,6-dichloro-N-(2,3-dihydro-1H-inden-2-yl)-1H-indole-2-carboxamide?
The canonical SMILES for 4,6-dichloro-N-(2,3-dihydro-1H-inden-2-yl)-1H-indole-2-carboxamide is O=C(NC1Cc2ccccc2C1)c1cc2c(Cl)cc(Cl)cc2[nH]1.
What is the InChIKey of 4,6-dichloro-N-(2,3-dihydro-1H-inden-2-yl)-1H-indole-2-carboxamide?
The InChIKey is HVEGQCXFHXQSRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14Cl2N2O/c19-12-7-15(20)14-9-17(22-16(14)8-12)18(23)21-13-5-10-3-1-2-4-11(10)6-13/h1-4,7-9,13,22H,5-6H2,(H,21,23).
What are the key properties of 4,6-dichloro-N-(2,3-dihydro-1H-inden-2-yl)-1H-indole-2-carboxamide?
4,6-dichloro-N-(2,3-dihydro-1H-inden-2-yl)-1H-indole-2-carboxamide has a molecular weight of 345.23 g/mol, XLogP of 4.37, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dichloro-N-(2,3-dihydro-1H-inden-2-yl)-1H-indole-2-carboxamide is sourced from PubChem (CID 90843687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).