(4S)-1-phenyl-4-propan-2-ylimidazolidin-2-one

C12H16N2O — CID 10845870

IUPAC(4S)-1-phenyl-4-propan-2-ylimidazolidin-2-one
SMILESCC(C)[C@H]1CN(c2ccccc2)C(=O)N1
InChIInChI=1S/C12H16N2O/c1-9(2)11-8-14(12(15)13-11)10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3,(H,13,15)/t11-/m1/s1
InChIKeyYNOMCRQMLCHORM-LLVKDONJSA-N
MW204.27 g/mol
LogP2.24
Rot. Bonds2

About (4S)-1-phenyl-4-propan-2-ylimidazolidin-2-one

(4S)-1-phenyl-4-propan-2-ylimidazolidin-2-one (PubChem CID 10845870) has the molecular formula C12H16N2O and a molecular weight of 204.27 g/mol. Its IUPAC name is (4S)-1-phenyl-4-propan-2-ylimidazolidin-2-one.

Molecular Properties

Compound Name(4S)-1-phenyl-4-propan-2-ylimidazolidin-2-one
PubChem CID10845870
Molecular FormulaC12H16N2O
Molecular Weight204.27 g/mol
Exact Mass204.13
IUPAC Name(4S)-1-phenyl-4-propan-2-ylimidazolidin-2-one
SMILESCC(C)[C@H]1CN(c2ccccc2)C(=O)N1
InChIInChI=1S/C12H16N2O/c1-9(2)11-8-14(12(15)13-11)10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3,(H,13,15)/t11-/m1/s1
InChIKeyYNOMCRQMLCHORM-LLVKDONJSA-N
XLogP2.24
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

Siduron
CID 16116
Fenuron
CID 7560
1,3-Dihydro-1-(4-piperidinyl)-2H-benzimidazol-2-one
CID 88638
N-Methyl-N',N'-diphenylurea
CID 25711
Urea, N-(1-methylethyl)-N'-phenyl-
CID 29852
1-Ebio
CID 82320
1-Methyl-3-phenylurea
CID 13880
1,3-dihydro-1-(1,2,3,6-tetrahydro-4-pyridinyl)-2H-benzimidazol-2-one
CID 75070
N-Cyclopentyl-N'-phenylurea
CID 25740
1-propyl-2,3-dihydro-1H-1,3-benzodiazol-2-one
CID 1527023
N-phenylpyrrolidine-1-carboxamide
CID 791811
1-Ethyl-1,3-diphenylurea
CID 98685

Frequently Asked Questions

What is the IUPAC name of (4S)-1-phenyl-4-propan-2-ylimidazolidin-2-one?
The IUPAC name of (4S)-1-phenyl-4-propan-2-ylimidazolidin-2-one (CID 10845870) is (4S)-1-phenyl-4-propan-2-ylimidazolidin-2-one.
What is the SMILES notation for (4S)-1-phenyl-4-propan-2-ylimidazolidin-2-one?
The canonical SMILES for (4S)-1-phenyl-4-propan-2-ylimidazolidin-2-one is CC(C)[C@H]1CN(c2ccccc2)C(=O)N1.
What is the InChIKey of (4S)-1-phenyl-4-propan-2-ylimidazolidin-2-one?
The InChIKey is YNOMCRQMLCHORM-LLVKDONJSA-N. The full InChI is InChI=1S/C12H16N2O/c1-9(2)11-8-14(12(15)13-11)10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3,(H,13,15)/t11-/m1/s1.
What are the key properties of (4S)-1-phenyl-4-propan-2-ylimidazolidin-2-one?
(4S)-1-phenyl-4-propan-2-ylimidazolidin-2-one has a molecular weight of 204.27 g/mol, XLogP of 2.24, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-1-phenyl-4-propan-2-ylimidazolidin-2-one is sourced from PubChem (CID 10845870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).