N'-[3,5-dichloro-4-(1H-indol-5-yloxy)phenyl]oxamide

C16H11Cl2N3O3 — CID 18614159

IUPACN'-[3,5-dichloro-4-(1H-indol-5-yloxy)phenyl]oxamide
SMILESNC(=O)C(=O)Nc1cc(Cl)c(Oc2ccc3[nH]ccc3c2)c(Cl)c1
InChIInChI=1S/C16H11Cl2N3O3/c17-11-6-9(21-16(23)15(19)22)7-12(18)14(11)24-10-1-2-13-8(5-10)3-4-20-13/h1-7,20H,(H2,19,22)(H,21,23)
InChIKeyWNMWOWBAZXPZIY-UHFFFAOYSA-N
MW364.19 g/mol
LogP3.69
Rot. Bonds3

About N'-[3,5-dichloro-4-(1H-indol-5-yloxy)phenyl]oxamide

N'-[3,5-dichloro-4-(1H-indol-5-yloxy)phenyl]oxamide (PubChem CID 18614159) has the molecular formula C16H11Cl2N3O3 and a molecular weight of 364.19 g/mol. Its IUPAC name is N'-[3,5-dichloro-4-(1H-indol-5-yloxy)phenyl]oxamide.

Molecular Properties

Compound NameN'-[3,5-dichloro-4-(1H-indol-5-yloxy)phenyl]oxamide
PubChem CID18614159
Molecular FormulaC16H11Cl2N3O3
Molecular Weight364.19 g/mol
Exact Mass363.02
IUPAC NameN'-[3,5-dichloro-4-(1H-indol-5-yloxy)phenyl]oxamide
SMILESNC(=O)C(=O)Nc1cc(Cl)c(Oc2ccc3[nH]ccc3c2)c(Cl)c1
InChIInChI=1S/C16H11Cl2N3O3/c17-11-6-9(21-16(23)15(19)22)7-12(18)14(11)24-10-1-2-13-8(5-10)3-4-20-13/h1-7,20H,(H2,19,22)(H,21,23)
InChIKeyWNMWOWBAZXPZIY-UHFFFAOYSA-N
XLogP3.69
TPSA97.21 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.19
LogP ≤ 53.69
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N'-[3,5-dichloro-4-(1H-indol-5-yloxy)phenyl]oxamide?
The IUPAC name of N'-[3,5-dichloro-4-(1H-indol-5-yloxy)phenyl]oxamide (CID 18614159) is N'-[3,5-dichloro-4-(1H-indol-5-yloxy)phenyl]oxamide.
What is the SMILES notation for N'-[3,5-dichloro-4-(1H-indol-5-yloxy)phenyl]oxamide?
The canonical SMILES for N'-[3,5-dichloro-4-(1H-indol-5-yloxy)phenyl]oxamide is NC(=O)C(=O)Nc1cc(Cl)c(Oc2ccc3[nH]ccc3c2)c(Cl)c1.
What is the InChIKey of N'-[3,5-dichloro-4-(1H-indol-5-yloxy)phenyl]oxamide?
The InChIKey is WNMWOWBAZXPZIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11Cl2N3O3/c17-11-6-9(21-16(23)15(19)22)7-12(18)14(11)24-10-1-2-13-8(5-10)3-4-20-13/h1-7,20H,(H2,19,22)(H,21,23).
What are the key properties of N'-[3,5-dichloro-4-(1H-indol-5-yloxy)phenyl]oxamide?
N'-[3,5-dichloro-4-(1H-indol-5-yloxy)phenyl]oxamide has a molecular weight of 364.19 g/mol, XLogP of 3.69, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[3,5-dichloro-4-(1H-indol-5-yloxy)phenyl]oxamide is sourced from PubChem (CID 18614159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).