2-(4-bromophenyl)-N-[4-(1-hydroxyethyl)phenyl]acetamide

C16H16BrNO2 — CID 91676875

IUPAC2-(4-bromophenyl)-N-[4-(1-hydroxyethyl)phenyl]acetamide
SMILESCC(O)c1ccc(NC(=O)Cc2ccc(Br)cc2)cc1
InChIInChI=1S/C16H16BrNO2/c1-11(19)13-4-8-15(9-5-13)18-16(20)10-12-2-6-14(17)7-3-12/h2-9,11,19H,10H2,1H3,(H,18,20)
InChIKeyUUJFARMLGQDLIL-UHFFFAOYSA-N
MW334.21 g/mol
LogP3.68
Rot. Bonds4

About 2-(4-bromophenyl)-N-[4-(1-hydroxyethyl)phenyl]acetamide

2-(4-bromophenyl)-N-[4-(1-hydroxyethyl)phenyl]acetamide (PubChem CID 91676875) has the molecular formula C16H16BrNO2 and a molecular weight of 334.21 g/mol. Its IUPAC name is 2-(4-bromophenyl)-N-[4-(1-hydroxyethyl)phenyl]acetamide.

Molecular Properties

Compound Name2-(4-bromophenyl)-N-[4-(1-hydroxyethyl)phenyl]acetamide
PubChem CID91676875
Molecular FormulaC16H16BrNO2
Molecular Weight334.21 g/mol
Exact Mass333.04
IUPAC Name2-(4-bromophenyl)-N-[4-(1-hydroxyethyl)phenyl]acetamide
SMILESCC(O)c1ccc(NC(=O)Cc2ccc(Br)cc2)cc1
InChIInChI=1S/C16H16BrNO2/c1-11(19)13-4-8-15(9-5-13)18-16(20)10-12-2-6-14(17)7-3-12/h2-9,11,19H,10H2,1H3,(H,18,20)
InChIKeyUUJFARMLGQDLIL-UHFFFAOYSA-N
XLogP3.68
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.21
LogP ≤ 53.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-bromophenyl)-N-[4-[(2R)-butan-2-yl]phenyl]acetamide
CID 7299572
2-(4-aminophenyl)-N-[4-[(1R)-1-hydroxyethyl]phenyl]acetamide
CID 100803515
N-[4-[(1R)-1-hydroxyethyl]phenyl]-2-phenylacetamide
CID 93090514
3-hydroxy-N-[4-(1-hydroxyethyl)phenyl]butanamide
CID 110178597
N-(4-bromophenyl)-2-(4-propan-2-ylsulfonylphenyl)acetamide
CID 16838362
2-(4-hydroxyphenyl)-N-(4-propan-2-ylphenyl)acetamide
CID 14879850
2-(4-bromophenyl)-N-(4-ethoxyphenyl)acetamide
CID 2268503
N-(4-bromophenyl)-2-(4-ethoxyphenyl)acetamide
CID 8719858
2-(4-bromophenyl)-N-(3,4-dimethylphenyl)acetamide
CID 2268328
2-(4-bromophenyl)-N-[4-(difluoromethylsulfanyl)phenyl]acetamide
CID 26908550
2-(4-bromophenyl)-N-[4-[(4,6-dimethylpyrimidin-2-yl)amino]phenyl]acetamide
CID 108743598
2-(4-bromophenyl)-N-[2-(4-methylanilino)-2-oxoethyl]acetamide
CID 112996188

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenyl)-N-[4-(1-hydroxyethyl)phenyl]acetamide?
The IUPAC name of 2-(4-bromophenyl)-N-[4-(1-hydroxyethyl)phenyl]acetamide (CID 91676875) is 2-(4-bromophenyl)-N-[4-(1-hydroxyethyl)phenyl]acetamide.
What is the SMILES notation for 2-(4-bromophenyl)-N-[4-(1-hydroxyethyl)phenyl]acetamide?
The canonical SMILES for 2-(4-bromophenyl)-N-[4-(1-hydroxyethyl)phenyl]acetamide is CC(O)c1ccc(NC(=O)Cc2ccc(Br)cc2)cc1.
What is the InChIKey of 2-(4-bromophenyl)-N-[4-(1-hydroxyethyl)phenyl]acetamide?
The InChIKey is UUJFARMLGQDLIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16BrNO2/c1-11(19)13-4-8-15(9-5-13)18-16(20)10-12-2-6-14(17)7-3-12/h2-9,11,19H,10H2,1H3,(H,18,20).
What are the key properties of 2-(4-bromophenyl)-N-[4-(1-hydroxyethyl)phenyl]acetamide?
2-(4-bromophenyl)-N-[4-(1-hydroxyethyl)phenyl]acetamide has a molecular weight of 334.21 g/mol, XLogP of 3.68, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenyl)-N-[4-(1-hydroxyethyl)phenyl]acetamide is sourced from PubChem (CID 91676875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).