N-[(2-bromophenyl)methyl]-2-[3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]acetamide

C19H19BrFN3O2 — CID 87049929

IUPACN-[(2-bromophenyl)methyl]-2-[3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]acetamide
SMILESO=C(CN1CCN(Cc2ccccc2F)C1=O)NCc1ccccc1Br
InChIInChI=1S/C19H19BrFN3O2/c20-16-7-3-1-5-14(16)11-22-18(25)13-24-10-9-23(19(24)26)12-15-6-2-4-8-17(15)21/h1-8H,9-13H2,(H,22,25)
InChIKeyURPJGNSQNDVCBT-UHFFFAOYSA-N
MW420.28 g/mol
LogP3.14
Rot. Bonds6

About N-[(2-bromophenyl)methyl]-2-[3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]acetamide

N-[(2-bromophenyl)methyl]-2-[3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]acetamide (PubChem CID 87049929) has the molecular formula C19H19BrFN3O2 and a molecular weight of 420.28 g/mol. Its IUPAC name is N-[(2-bromophenyl)methyl]-2-[3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]acetamide.

Molecular Properties

Compound NameN-[(2-bromophenyl)methyl]-2-[3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]acetamide
PubChem CID87049929
Molecular FormulaC19H19BrFN3O2
Molecular Weight420.28 g/mol
Exact Mass419.06
IUPAC NameN-[(2-bromophenyl)methyl]-2-[3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]acetamide
SMILESO=C(CN1CCN(Cc2ccccc2F)C1=O)NCc1ccccc1Br
InChIInChI=1S/C19H19BrFN3O2/c20-16-7-3-1-5-14(16)11-22-18(25)13-24-10-9-23(19(24)26)12-15-6-2-4-8-17(15)21/h1-8H,9-13H2,(H,22,25)
InChIKeyURPJGNSQNDVCBT-UHFFFAOYSA-N
XLogP3.14
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500420.28
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-benzyl-2-oxoimidazolidin-1-yl)-N-[(2-bromophenyl)methyl]acetamide
CID 87049951
N-[(2-fluorophenyl)methyl]-2-[4-[2-[(2-fluorophenyl)methylamino]-2-oxoethyl]-1,4-diazepan-1-yl]acetamide
CID 31313746
N-[(2-fluorophenyl)methyl]carbamoyl bromide
CID 115193660
2-(3-benzyl-2-oxoimidazolidin-1-yl)-N-[(4-fluorophenyl)methyl]acetamide
CID 4287057
2-(2-bromophenyl)sulfanyl-N-[(2-fluorophenyl)methyl]acetamide
CID 18098876
1-[2-[(2-fluorophenyl)methylamino]-2-oxoethyl]pyrrole-2-carboxylic acid
CID 79325322
N-(4-fluorophenyl)-4-[2-[(2-fluorophenyl)methylamino]-2-oxoethyl]-3-oxopiperazine-1-carboxamide
CID 50832895
2-[3-[(2-methylphenyl)methyl]-2-oxoimidazolidin-1-yl]-N-(thiophen-2-ylmethyl)acetamide
CID 3511301
N-[(2-fluorophenyl)methyl]-2-[4-(2-fluorophenyl)piperazin-1-yl]acetamide
CID 26553275
2-[3-[(2-chloro-4-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-[(4-chlorophenyl)methyl]acetamide
CID 6621641
2-[4-(2-bromophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[(2-fluorophenyl)methyl]acetamide
CID 55399827
N-[(2-bromophenyl)methyl]-2-hydroxyacetamide
CID 115139901

Frequently Asked Questions

What is the IUPAC name of N-[(2-bromophenyl)methyl]-2-[3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]acetamide?
The IUPAC name of N-[(2-bromophenyl)methyl]-2-[3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]acetamide (CID 87049929) is N-[(2-bromophenyl)methyl]-2-[3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]acetamide.
What is the SMILES notation for N-[(2-bromophenyl)methyl]-2-[3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]acetamide?
The canonical SMILES for N-[(2-bromophenyl)methyl]-2-[3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]acetamide is O=C(CN1CCN(Cc2ccccc2F)C1=O)NCc1ccccc1Br.
What is the InChIKey of N-[(2-bromophenyl)methyl]-2-[3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]acetamide?
The InChIKey is URPJGNSQNDVCBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19BrFN3O2/c20-16-7-3-1-5-14(16)11-22-18(25)13-24-10-9-23(19(24)26)12-15-6-2-4-8-17(15)21/h1-8H,9-13H2,(H,22,25).
What are the key properties of N-[(2-bromophenyl)methyl]-2-[3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]acetamide?
N-[(2-bromophenyl)methyl]-2-[3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]acetamide has a molecular weight of 420.28 g/mol, XLogP of 3.14, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-bromophenyl)methyl]-2-[3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]acetamide is sourced from PubChem (CID 87049929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).