(4R)-4-(4-bromophenyl)-1-methylimidazolidin-2-one

C10H11BrN2O — CID 162419401

IUPAC(4R)-4-(4-bromophenyl)-1-methylimidazolidin-2-one
SMILESCN1C[C@@H](c2ccc(Br)cc2)NC1=O
InChIInChI=1S/C10H11BrN2O/c1-13-6-9(12-10(13)14)7-2-4-8(11)5-3-7/h2-5,9H,6H2,1H3,(H,12,14)/t9-/m0/s1
InChIKeyHWYXVKXLSVDUKZ-VIFPVBQESA-N
MW255.12 g/mol
LogP2.15
Rot. Bonds1

About (4R)-4-(4-bromophenyl)-1-methylimidazolidin-2-one

(4R)-4-(4-bromophenyl)-1-methylimidazolidin-2-one (PubChem CID 162419401) has the molecular formula C10H11BrN2O and a molecular weight of 255.12 g/mol. Its IUPAC name is (4R)-4-(4-bromophenyl)-1-methylimidazolidin-2-one.

Molecular Properties

Compound Name(4R)-4-(4-bromophenyl)-1-methylimidazolidin-2-one
PubChem CID162419401
Molecular FormulaC10H11BrN2O
Molecular Weight255.12 g/mol
Exact Mass254.01
IUPAC Name(4R)-4-(4-bromophenyl)-1-methylimidazolidin-2-one
SMILESCN1C[C@@H](c2ccc(Br)cc2)NC1=O
InChIInChI=1S/C10H11BrN2O/c1-13-6-9(12-10(13)14)7-2-4-8(11)5-3-7/h2-5,9H,6H2,1H3,(H,12,14)/t9-/m0/s1
InChIKeyHWYXVKXLSVDUKZ-VIFPVBQESA-N
XLogP2.15
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.12
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (4R)-4-(4-bromophenyl)-1-methylimidazolidin-2-one?
The IUPAC name of (4R)-4-(4-bromophenyl)-1-methylimidazolidin-2-one (CID 162419401) is (4R)-4-(4-bromophenyl)-1-methylimidazolidin-2-one.
What is the SMILES notation for (4R)-4-(4-bromophenyl)-1-methylimidazolidin-2-one?
The canonical SMILES for (4R)-4-(4-bromophenyl)-1-methylimidazolidin-2-one is CN1C[C@@H](c2ccc(Br)cc2)NC1=O.
What is the InChIKey of (4R)-4-(4-bromophenyl)-1-methylimidazolidin-2-one?
The InChIKey is HWYXVKXLSVDUKZ-VIFPVBQESA-N. The full InChI is InChI=1S/C10H11BrN2O/c1-13-6-9(12-10(13)14)7-2-4-8(11)5-3-7/h2-5,9H,6H2,1H3,(H,12,14)/t9-/m0/s1.
What are the key properties of (4R)-4-(4-bromophenyl)-1-methylimidazolidin-2-one?
(4R)-4-(4-bromophenyl)-1-methylimidazolidin-2-one has a molecular weight of 255.12 g/mol, XLogP of 2.15, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-(4-bromophenyl)-1-methylimidazolidin-2-one is sourced from PubChem (CID 162419401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).