N-(4-bromo-2-methylphenyl)-N'-[1-(4-ethylphenyl)ethyl]oxamide

C19H21BrN2O2 — CID 108511113

IUPACN-(4-bromo-2-methylphenyl)-N'-[1-(4-ethylphenyl)ethyl]oxamide
SMILESCCc1ccc(C(C)NC(=O)C(=O)Nc2ccc(Br)cc2C)cc1
InChIInChI=1S/C19H21BrN2O2/c1-4-14-5-7-15(8-6-14)13(3)21-18(23)19(24)22-17-10-9-16(20)11-12(17)2/h5-11,13H,4H2,1-3H3,(H,21,23)(H,22,24)
InChIKeyBVUBCHPOBCOKNS-UHFFFAOYSA-N
MW389.29 g/mol
LogP4.14
Rot. Bonds4

About N-(4-bromo-2-methylphenyl)-N'-[1-(4-ethylphenyl)ethyl]oxamide

N-(4-bromo-2-methylphenyl)-N'-[1-(4-ethylphenyl)ethyl]oxamide (PubChem CID 108511113) has the molecular formula C19H21BrN2O2 and a molecular weight of 389.29 g/mol. Its IUPAC name is N-(4-bromo-2-methylphenyl)-N'-[1-(4-ethylphenyl)ethyl]oxamide.

Molecular Properties

Compound NameN-(4-bromo-2-methylphenyl)-N'-[1-(4-ethylphenyl)ethyl]oxamide
PubChem CID108511113
Molecular FormulaC19H21BrN2O2
Molecular Weight389.29 g/mol
Exact Mass388.08
IUPAC NameN-(4-bromo-2-methylphenyl)-N'-[1-(4-ethylphenyl)ethyl]oxamide
SMILESCCc1ccc(C(C)NC(=O)C(=O)Nc2ccc(Br)cc2C)cc1
InChIInChI=1S/C19H21BrN2O2/c1-4-14-5-7-15(8-6-14)13(3)21-18(23)19(24)22-17-10-9-16(20)11-12(17)2/h5-11,13H,4H2,1-3H3,(H,21,23)(H,22,24)
InChIKeyBVUBCHPOBCOKNS-UHFFFAOYSA-N
XLogP4.14
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.29
LogP ≤ 54.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(3,5-dimethylphenyl)-N'-[1-(4-ethylphenyl)ethyl]oxamide
CID 108511070
N-(5-chloro-2-methylphenyl)-N'-[1-(4-ethylphenyl)ethyl]oxamide
CID 108510908
N-(2,4-dichlorophenyl)-N'-[1-(4-ethylphenyl)ethyl]oxamide
CID 108502742
N-(2,5-difluorophenyl)-N'-[1-(4-ethylphenyl)ethyl]oxamide
CID 108511128
N'-[(1S)-1-(4-ethylphenyl)ethyl]-N-(5-methyl-1,2-oxazol-3-yl)oxamide
CID 51959353
N-(2,3-dichlorophenyl)-N'-[1-(4-ethylphenyl)ethyl]oxamide
CID 108500692
5-bromo-2-chloro-N-[1-(4-ethylphenyl)ethyl]benzamide
CID 17327083
1-(4-bromo-2-chlorophenyl)-3-[1-(4-ethylphenyl)ethyl]thiourea
CID 17300793
N-[3,5-bis(trifluoromethyl)phenyl]-N'-[1-(4-ethylphenyl)ethyl]oxamide
CID 108511055
N-(4-bromo-2-methylphenyl)-2-[[2-[1-(4-fluorophenyl)ethylamino]-2-oxoethyl]-methylamino]acetamide
CID 46802089
N-(4-chloro-2-methylphenyl)-N'-[1-(4-methoxyphenyl)ethyl]oxamide
CID 108510319
1-[1-(4-bromophenyl)ethyl]-3-(4-butyl-2-methylphenyl)thiourea
CID 3843357

Frequently Asked Questions

What is the IUPAC name of N-(4-bromo-2-methylphenyl)-N'-[1-(4-ethylphenyl)ethyl]oxamide?
The IUPAC name of N-(4-bromo-2-methylphenyl)-N'-[1-(4-ethylphenyl)ethyl]oxamide (CID 108511113) is N-(4-bromo-2-methylphenyl)-N'-[1-(4-ethylphenyl)ethyl]oxamide.
What is the SMILES notation for N-(4-bromo-2-methylphenyl)-N'-[1-(4-ethylphenyl)ethyl]oxamide?
The canonical SMILES for N-(4-bromo-2-methylphenyl)-N'-[1-(4-ethylphenyl)ethyl]oxamide is CCc1ccc(C(C)NC(=O)C(=O)Nc2ccc(Br)cc2C)cc1.
What is the InChIKey of N-(4-bromo-2-methylphenyl)-N'-[1-(4-ethylphenyl)ethyl]oxamide?
The InChIKey is BVUBCHPOBCOKNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21BrN2O2/c1-4-14-5-7-15(8-6-14)13(3)21-18(23)19(24)22-17-10-9-16(20)11-12(17)2/h5-11,13H,4H2,1-3H3,(H,21,23)(H,22,24).
What are the key properties of N-(4-bromo-2-methylphenyl)-N'-[1-(4-ethylphenyl)ethyl]oxamide?
N-(4-bromo-2-methylphenyl)-N'-[1-(4-ethylphenyl)ethyl]oxamide has a molecular weight of 389.29 g/mol, XLogP of 4.14, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromo-2-methylphenyl)-N'-[1-(4-ethylphenyl)ethyl]oxamide is sourced from PubChem (CID 108511113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).