N-(2-bromo-4-ethylphenyl)-3-(4-propan-2-ylphenyl)propanamide

C20H24BrNO — CID 53268011

IUPACN-(2-bromo-4-ethylphenyl)-3-(4-propan-2-ylphenyl)propanamide
SMILESCCc1ccc(NC(=O)CCc2ccc(C(C)C)cc2)c(Br)c1
InChIInChI=1S/C20H24BrNO/c1-4-15-7-11-19(18(21)13-15)22-20(23)12-8-16-5-9-17(10-6-16)14(2)3/h5-7,9-11,13-14H,4,8,12H2,1-3H3,(H,22,23)
InChIKeyLWPYNQORQGSCHJ-UHFFFAOYSA-N
MW374.32 g/mol
LogP5.71
Rot. Bonds6

About N-(2-bromo-4-ethylphenyl)-3-(4-propan-2-ylphenyl)propanamide

N-(2-bromo-4-ethylphenyl)-3-(4-propan-2-ylphenyl)propanamide (PubChem CID 53268011) has the molecular formula C20H24BrNO and a molecular weight of 374.32 g/mol. Its IUPAC name is N-(2-bromo-4-ethylphenyl)-3-(4-propan-2-ylphenyl)propanamide.

Molecular Properties

Compound NameN-(2-bromo-4-ethylphenyl)-3-(4-propan-2-ylphenyl)propanamide
PubChem CID53268011
Molecular FormulaC20H24BrNO
Molecular Weight374.32 g/mol
Exact Mass373.10
IUPAC NameN-(2-bromo-4-ethylphenyl)-3-(4-propan-2-ylphenyl)propanamide
SMILESCCc1ccc(NC(=O)CCc2ccc(C(C)C)cc2)c(Br)c1
InChIInChI=1S/C20H24BrNO/c1-4-15-7-11-19(18(21)13-15)22-20(23)12-8-16-5-9-17(10-6-16)14(2)3/h5-7,9-11,13-14H,4,8,12H2,1-3H3,(H,22,23)
InChIKeyLWPYNQORQGSCHJ-UHFFFAOYSA-N
XLogP5.71
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500374.32
LogP ≤ 55.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-(2-bromo-4-ethylphenyl)-3-(4-propan-2-ylphenyl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(4-bromo-2-chlorophenyl)-3-(4-propan-2-ylphenyl)propanamide
CID 53267799
N-(2-bromo-4-ethylphenyl)-4-chlorobutanamide
CID 53268191
N-(2,6-diethylphenyl)-3-(4-propan-2-ylphenyl)propanamide
CID 19221408
N-(2-bromo-4-butylphenyl)-3-(4-tert-butylphenyl)propanamide
CID 53267643
(E)-N-(2-bromo-4-ethylphenyl)-2-cyano-3-(4-propan-2-ylphenyl)prop-2-enamide
CID 53268116
N-(2-bromo-4-ethylphenyl)-4-(4-ethylphenoxy)butanamide
CID 53268051
N-(2,3-dimethylphenyl)-3-(4-propan-2-ylphenyl)propanamide
CID 19221393
N-methyl-3-(4-propan-2-ylphenyl)propanamide
CID 41455606
N-(2-bromo-4-ethylphenyl)-4-(4-chlorophenoxy)butanamide
CID 53268050
N-(2-bromo-4-methylphenyl)-3-phenylpropanamide
CID 730069
N-(4-hydroxyphenyl)-3-(4-propan-2-ylphenyl)propanamide
CID 56659537
(E)-N-(2-bromo-4-butylphenyl)-3-(4-propan-2-ylphenyl)prop-2-enamide
CID 53267822

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-4-ethylphenyl)-3-(4-propan-2-ylphenyl)propanamide?
The IUPAC name of N-(2-bromo-4-ethylphenyl)-3-(4-propan-2-ylphenyl)propanamide (CID 53268011) is N-(2-bromo-4-ethylphenyl)-3-(4-propan-2-ylphenyl)propanamide.
What is the SMILES notation for N-(2-bromo-4-ethylphenyl)-3-(4-propan-2-ylphenyl)propanamide?
The canonical SMILES for N-(2-bromo-4-ethylphenyl)-3-(4-propan-2-ylphenyl)propanamide is CCc1ccc(NC(=O)CCc2ccc(C(C)C)cc2)c(Br)c1.
What is the InChIKey of N-(2-bromo-4-ethylphenyl)-3-(4-propan-2-ylphenyl)propanamide?
The InChIKey is LWPYNQORQGSCHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24BrNO/c1-4-15-7-11-19(18(21)13-15)22-20(23)12-8-16-5-9-17(10-6-16)14(2)3/h5-7,9-11,13-14H,4,8,12H2,1-3H3,(H,22,23).
What are the key properties of N-(2-bromo-4-ethylphenyl)-3-(4-propan-2-ylphenyl)propanamide?
N-(2-bromo-4-ethylphenyl)-3-(4-propan-2-ylphenyl)propanamide has a molecular weight of 374.32 g/mol, XLogP of 5.71, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromo-4-ethylphenyl)-3-(4-propan-2-ylphenyl)propanamide is sourced from PubChem (CID 53268011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).