N-(3,5-dichloro-4-pyridinyl)-3-methyl-1H-indole-6-carboxamide

C15H11Cl2N3O — CID 22663193

IUPACN-(3,5-dichloro-4-pyridinyl)-3-methyl-1H-indole-6-carboxamide
SMILESCc1c[nH]c2cc(C(=O)Nc3c(Cl)cncc3Cl)ccc12
InChIInChI=1S/C15H11Cl2N3O/c1-8-5-19-13-4-9(2-3-10(8)13)15(21)20-14-11(16)6-18-7-12(14)17/h2-7,19H,1H3,(H,18,20,21)
InChIKeyONVLPDRKPJLPDE-UHFFFAOYSA-N
MW320.18 g/mol
LogP4.43
Rot. Bonds2

About N-(3,5-dichloro-4-pyridinyl)-3-methyl-1H-indole-6-carboxamide

N-(3,5-dichloro-4-pyridinyl)-3-methyl-1H-indole-6-carboxamide (PubChem CID 22663193) has the molecular formula C15H11Cl2N3O and a molecular weight of 320.18 g/mol. Its IUPAC name is N-(3,5-dichloro-4-pyridinyl)-3-methyl-1H-indole-6-carboxamide.

Molecular Properties

Compound NameN-(3,5-dichloro-4-pyridinyl)-3-methyl-1H-indole-6-carboxamide
PubChem CID22663193
Molecular FormulaC15H11Cl2N3O
Molecular Weight320.18 g/mol
Exact Mass319.03
IUPAC NameN-(3,5-dichloro-4-pyridinyl)-3-methyl-1H-indole-6-carboxamide
SMILESCc1c[nH]c2cc(C(=O)Nc3c(Cl)cncc3Cl)ccc12
InChIInChI=1S/C15H11Cl2N3O/c1-8-5-19-13-4-9(2-3-10(8)13)15(21)20-14-11(16)6-18-7-12(14)17/h2-7,19H,1H3,(H,18,20,21)
InChIKeyONVLPDRKPJLPDE-UHFFFAOYSA-N
XLogP4.43
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.18
LogP ≤ 54.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(3,5-dichloro-4-pyridinyl)-3-methyl-1H-indole-6-carboxamide?
The IUPAC name of N-(3,5-dichloro-4-pyridinyl)-3-methyl-1H-indole-6-carboxamide (CID 22663193) is N-(3,5-dichloro-4-pyridinyl)-3-methyl-1H-indole-6-carboxamide.
What is the SMILES notation for N-(3,5-dichloro-4-pyridinyl)-3-methyl-1H-indole-6-carboxamide?
The canonical SMILES for N-(3,5-dichloro-4-pyridinyl)-3-methyl-1H-indole-6-carboxamide is Cc1c[nH]c2cc(C(=O)Nc3c(Cl)cncc3Cl)ccc12.
What is the InChIKey of N-(3,5-dichloro-4-pyridinyl)-3-methyl-1H-indole-6-carboxamide?
The InChIKey is ONVLPDRKPJLPDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11Cl2N3O/c1-8-5-19-13-4-9(2-3-10(8)13)15(21)20-14-11(16)6-18-7-12(14)17/h2-7,19H,1H3,(H,18,20,21).
What are the key properties of N-(3,5-dichloro-4-pyridinyl)-3-methyl-1H-indole-6-carboxamide?
N-(3,5-dichloro-4-pyridinyl)-3-methyl-1H-indole-6-carboxamide has a molecular weight of 320.18 g/mol, XLogP of 4.43, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dichloro-4-pyridinyl)-3-methyl-1H-indole-6-carboxamide is sourced from PubChem (CID 22663193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).