1-(2,4-dibromophenyl)-3-ethylurea

C9H10Br2N2O — CID 102364568

IUPAC1-(2,4-dibromophenyl)-3-ethylurea
SMILESCCNC(=O)Nc1ccc(Br)cc1Br
InChIInChI=1S/C9H10Br2N2O/c1-2-12-9(14)13-8-4-3-6(10)5-7(8)11/h3-5H,2H2,1H3,(H2,12,13,14)
InChIKeyIGYKZCFHLGTHHE-UHFFFAOYSA-N
MW322.00 g/mol
LogP3.35
Rot. Bonds2

About 1-(2,4-dibromophenyl)-3-ethylurea

1-(2,4-dibromophenyl)-3-ethylurea (PubChem CID 102364568) has the molecular formula C9H10Br2N2O and a molecular weight of 322.00 g/mol. Its IUPAC name is 1-(2,4-dibromophenyl)-3-ethylurea.

Molecular Properties

Compound Name1-(2,4-dibromophenyl)-3-ethylurea
PubChem CID102364568
Molecular FormulaC9H10Br2N2O
Molecular Weight322.00 g/mol
Exact Mass319.92
IUPAC Name1-(2,4-dibromophenyl)-3-ethylurea
SMILESCCNC(=O)Nc1ccc(Br)cc1Br
InChIInChI=1S/C9H10Br2N2O/c1-2-12-9(14)13-8-4-3-6(10)5-7(8)11/h3-5H,2H2,1H3,(H2,12,13,14)
InChIKeyIGYKZCFHLGTHHE-UHFFFAOYSA-N
XLogP3.35
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.00
LogP ≤ 53.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

1-[4-bromo-2-(trifluoromethyl)phenyl]-3-ethylurea
CID 113225657
1-(2,4-dibromophenyl)-3-[(2S)-2-hydroxypropyl]urea
CID 51944658
1-(5-bromo-2-chlorophenyl)-3-ethylurea
CID 60981700
methyl 5-bromo-2-(ethylcarbamoylamino)benzoate
CID 799287
3-[(2,4-dibromophenyl)carbamoylamino]propanoic acid
CID 54954210
1-[4-bromo-2-[(Z)-N'-hydroxycarbamimidoyl]phenyl]-3-ethylurea
CID 82703646
1-(4-bromo-2,3-difluorophenyl)-3-ethylurea
CID 66687850
5-[(2,4-dibromophenyl)carbamoylamino]-2-methylpentanoic acid
CID 104686390
2-chloro-N-[(2,4-dibromophenyl)carbamoyl]acetamide
CID 61475658
[2-(2,4-dibromoanilino)-2-oxoethyl] N,N'-diethylcarbamimidothioate
CID 4968515
1-(4-bromo-2-ethylphenyl)-3-propylurea
CID 6467713
N-(2,4-dibromophenyl)hexanamide
CID 4251482

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dibromophenyl)-3-ethylurea?
The IUPAC name of 1-(2,4-dibromophenyl)-3-ethylurea (CID 102364568) is 1-(2,4-dibromophenyl)-3-ethylurea.
What is the SMILES notation for 1-(2,4-dibromophenyl)-3-ethylurea?
The canonical SMILES for 1-(2,4-dibromophenyl)-3-ethylurea is CCNC(=O)Nc1ccc(Br)cc1Br.
What is the InChIKey of 1-(2,4-dibromophenyl)-3-ethylurea?
The InChIKey is IGYKZCFHLGTHHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10Br2N2O/c1-2-12-9(14)13-8-4-3-6(10)5-7(8)11/h3-5H,2H2,1H3,(H2,12,13,14).
What are the key properties of 1-(2,4-dibromophenyl)-3-ethylurea?
1-(2,4-dibromophenyl)-3-ethylurea has a molecular weight of 322.00 g/mol, XLogP of 3.35, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dibromophenyl)-3-ethylurea is sourced from PubChem (CID 102364568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).