N'-(4-chlorophenyl)-N-[2-(3-chlorophenyl)-2-methoxypropyl]oxamide

C18H18Cl2N2O3 — CID 90600132

IUPACN'-(4-chlorophenyl)-N-[2-(3-chlorophenyl)-2-methoxypropyl]oxamide
SMILESCOC(C)(CNC(=O)C(=O)Nc1ccc(Cl)cc1)c1cccc(Cl)c1
InChIInChI=1S/C18H18Cl2N2O3/c1-18(25-2,12-4-3-5-14(20)10-12)11-21-16(23)17(24)22-15-8-6-13(19)7-9-15/h3-10H,11H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyRCNZDQQPMHUSHM-UHFFFAOYSA-N
MW381.26 g/mol
LogP3.61
Rot. Bonds5

About N'-(4-chlorophenyl)-N-[2-(3-chlorophenyl)-2-methoxypropyl]oxamide

N'-(4-chlorophenyl)-N-[2-(3-chlorophenyl)-2-methoxypropyl]oxamide (PubChem CID 90600132) has the molecular formula C18H18Cl2N2O3 and a molecular weight of 381.26 g/mol. Its IUPAC name is N'-(4-chlorophenyl)-N-[2-(3-chlorophenyl)-2-methoxypropyl]oxamide.

Molecular Properties

Compound NameN'-(4-chlorophenyl)-N-[2-(3-chlorophenyl)-2-methoxypropyl]oxamide
PubChem CID90600132
Molecular FormulaC18H18Cl2N2O3
Molecular Weight381.26 g/mol
Exact Mass380.07
IUPAC NameN'-(4-chlorophenyl)-N-[2-(3-chlorophenyl)-2-methoxypropyl]oxamide
SMILESCOC(C)(CNC(=O)C(=O)Nc1ccc(Cl)cc1)c1cccc(Cl)c1
InChIInChI=1S/C18H18Cl2N2O3/c1-18(25-2,12-4-3-5-14(20)10-12)11-21-16(23)17(24)22-15-8-6-13(19)7-9-15/h3-10H,11H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyRCNZDQQPMHUSHM-UHFFFAOYSA-N
XLogP3.61
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.26
LogP ≤ 53.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N'-(3-acetamidophenyl)-N-[2-(3-chlorophenyl)-2-methoxypropyl]oxamide
CID 90600155
N-benzyl-N'-[2-(3-chlorophenyl)-2-methoxypropyl]oxamide
CID 90600108
N'-[2-(3-chlorophenyl)-2-methoxypropyl]-N-[(2-chlorophenyl)methyl]oxamide
CID 90600151
1-[2-(3-chlorophenyl)-2-methoxypropyl]-3-(4-ethoxyphenyl)urea
CID 90600200
1-[2-(3-chlorophenyl)-2-methoxypropyl]-3-[(4-chlorophenyl)methyl]urea
CID 90600204
N-[2-(3-chlorophenyl)-2-methoxypropyl]-N'-[1-(2-methylpropanoyl)-3,4-dihydro-2H-quinolin-7-yl]oxamide
CID 90600175
1-[2-(3-chlorophenyl)-2-methoxypropyl]-3-(2-methoxyethyl)urea
CID 90600185
1-[2-(3-chlorophenyl)-2-methoxypropyl]-3-(2-methoxyphenyl)urea
CID 90600196
N-[2-(3-chlorophenyl)-2-methoxypropyl]pyridine-3-carboxamide
CID 90599834
N-[2-(3-chlorophenyl)-2-methoxypropyl]-4-ethoxybenzamide
CID 90599881
N-[2-(3-chlorophenyl)-2-methoxypropyl]-4-phenoxybenzamide
CID 90599957
N'-(3-chlorophenyl)-N-(2-hydroxy-3-methoxy-2-methylpropyl)oxamide
CID 90501064

Frequently Asked Questions

What is the IUPAC name of N'-(4-chlorophenyl)-N-[2-(3-chlorophenyl)-2-methoxypropyl]oxamide?
The IUPAC name of N'-(4-chlorophenyl)-N-[2-(3-chlorophenyl)-2-methoxypropyl]oxamide (CID 90600132) is N'-(4-chlorophenyl)-N-[2-(3-chlorophenyl)-2-methoxypropyl]oxamide.
What is the SMILES notation for N'-(4-chlorophenyl)-N-[2-(3-chlorophenyl)-2-methoxypropyl]oxamide?
The canonical SMILES for N'-(4-chlorophenyl)-N-[2-(3-chlorophenyl)-2-methoxypropyl]oxamide is COC(C)(CNC(=O)C(=O)Nc1ccc(Cl)cc1)c1cccc(Cl)c1.
What is the InChIKey of N'-(4-chlorophenyl)-N-[2-(3-chlorophenyl)-2-methoxypropyl]oxamide?
The InChIKey is RCNZDQQPMHUSHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18Cl2N2O3/c1-18(25-2,12-4-3-5-14(20)10-12)11-21-16(23)17(24)22-15-8-6-13(19)7-9-15/h3-10H,11H2,1-2H3,(H,21,23)(H,22,24).
What are the key properties of N'-(4-chlorophenyl)-N-[2-(3-chlorophenyl)-2-methoxypropyl]oxamide?
N'-(4-chlorophenyl)-N-[2-(3-chlorophenyl)-2-methoxypropyl]oxamide has a molecular weight of 381.26 g/mol, XLogP of 3.61, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-chlorophenyl)-N-[2-(3-chlorophenyl)-2-methoxypropyl]oxamide is sourced from PubChem (CID 90600132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).