N'-(2,3-dichlorophenyl)-N-[2-(1H-indol-3-yl)ethyl]oxamide

C18H15Cl2N3O2 — CID 3972637

IUPACN'-(2,3-dichlorophenyl)-N-[2-(1H-indol-3-yl)ethyl]oxamide
SMILESO=C(NCCc1c[nH]c2ccccc12)C(=O)Nc1cccc(Cl)c1Cl
InChIInChI=1S/C18H15Cl2N3O2/c19-13-5-3-7-15(16(13)20)23-18(25)17(24)21-9-8-11-10-22-14-6-2-1-4-12(11)14/h1-7,10,22H,8-9H2,(H,21,24)(H,23,25)
InChIKeyOISGBVHLDUCXBH-UHFFFAOYSA-N
MW376.24 g/mol
LogP3.77
Rot. Bonds4

About N'-(2,3-dichlorophenyl)-N-[2-(1H-indol-3-yl)ethyl]oxamide

N'-(2,3-dichlorophenyl)-N-[2-(1H-indol-3-yl)ethyl]oxamide (PubChem CID 3972637) has the molecular formula C18H15Cl2N3O2 and a molecular weight of 376.24 g/mol. Its IUPAC name is N'-(2,3-dichlorophenyl)-N-[2-(1H-indol-3-yl)ethyl]oxamide.

Molecular Properties

Compound NameN'-(2,3-dichlorophenyl)-N-[2-(1H-indol-3-yl)ethyl]oxamide
PubChem CID3972637
Molecular FormulaC18H15Cl2N3O2
Molecular Weight376.24 g/mol
Exact Mass375.05
IUPAC NameN'-(2,3-dichlorophenyl)-N-[2-(1H-indol-3-yl)ethyl]oxamide
SMILESO=C(NCCc1c[nH]c2ccccc12)C(=O)Nc1cccc(Cl)c1Cl
InChIInChI=1S/C18H15Cl2N3O2/c19-13-5-3-7-15(16(13)20)23-18(25)17(24)21-9-8-11-10-22-14-6-2-1-4-12(11)14/h1-7,10,22H,8-9H2,(H,21,24)(H,23,25)
InChIKeyOISGBVHLDUCXBH-UHFFFAOYSA-N
XLogP3.77
TPSA73.99 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.24
LogP ≤ 53.77
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2,3-dichloro-N-[2-(1H-indol-3-yl)ethyl]benzamide
CID 27645249
N'-(2,6-diethylphenyl)-N-[2-(1H-indol-3-yl)ethyl]oxamide
CID 108511537
1-(3-chloro-2-methylphenyl)-3-[2-(1H-indol-3-yl)ethyl]thiourea
CID 702579
N'-[4-(dimethylamino)phenyl]-N-[2-(1H-indol-3-yl)ethyl]oxamide
CID 7585548
2-chloro-N-[2-(1H-indol-3-yl)ethyl]aniline
CID 171397349
N-[2-(1H-indol-3-yl)ethyl]-N'-propan-2-yloxamide
CID 2026350
[2-(2,3-dichloroanilino)-2-oxoethyl] 4-(1H-indol-3-yl)butanoate
CID 2434282
1-[2-(1H-indol-3-yl)ethyl]-3-(2-methylphenyl)urea
CID 2238398
1-[2-(2,4-dichlorophenyl)ethyl]-3-[2-(1H-indol-3-yl)ethyl]urea
CID 108989626
N'-[(2-fluorophenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]oxamide
CID 108531516
N-(2,3-dichlorophenyl)-1H-indole-3-carboxamide
CID 43399264
1-N,4-N-bis[2-(1H-indol-3-yl)ethyl]benzene-1,4-dicarboxamide
CID 42988811

Frequently Asked Questions

What is the IUPAC name of N'-(2,3-dichlorophenyl)-N-[2-(1H-indol-3-yl)ethyl]oxamide?
The IUPAC name of N'-(2,3-dichlorophenyl)-N-[2-(1H-indol-3-yl)ethyl]oxamide (CID 3972637) is N'-(2,3-dichlorophenyl)-N-[2-(1H-indol-3-yl)ethyl]oxamide.
What is the SMILES notation for N'-(2,3-dichlorophenyl)-N-[2-(1H-indol-3-yl)ethyl]oxamide?
The canonical SMILES for N'-(2,3-dichlorophenyl)-N-[2-(1H-indol-3-yl)ethyl]oxamide is O=C(NCCc1c[nH]c2ccccc12)C(=O)Nc1cccc(Cl)c1Cl.
What is the InChIKey of N'-(2,3-dichlorophenyl)-N-[2-(1H-indol-3-yl)ethyl]oxamide?
The InChIKey is OISGBVHLDUCXBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15Cl2N3O2/c19-13-5-3-7-15(16(13)20)23-18(25)17(24)21-9-8-11-10-22-14-6-2-1-4-12(11)14/h1-7,10,22H,8-9H2,(H,21,24)(H,23,25).
What are the key properties of N'-(2,3-dichlorophenyl)-N-[2-(1H-indol-3-yl)ethyl]oxamide?
N'-(2,3-dichlorophenyl)-N-[2-(1H-indol-3-yl)ethyl]oxamide has a molecular weight of 376.24 g/mol, XLogP of 3.77, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2,3-dichlorophenyl)-N-[2-(1H-indol-3-yl)ethyl]oxamide is sourced from PubChem (CID 3972637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).