(5S)-3-methyl-5-(naphthalen-2-ylmethyl)imidazolidin-4-one

C15H16N2O — CID 59884171

IUPAC(5S)-3-methyl-5-(naphthalen-2-ylmethyl)imidazolidin-4-one
SMILESCN1CN[C@@H](Cc2ccc3ccccc3c2)C1=O
InChIInChI=1S/C15H16N2O/c1-17-10-16-14(15(17)18)9-11-6-7-12-4-2-3-5-13(12)8-11/h2-8,14,16H,9-10H2,1H3/t14-/m0/s1
InChIKeyWMUHPDJMMFBUJL-AWEZNQCLSA-N
MW240.31 g/mol
LogP1.77
Rot. Bonds2

About (5S)-3-methyl-5-(naphthalen-2-ylmethyl)imidazolidin-4-one

(5S)-3-methyl-5-(naphthalen-2-ylmethyl)imidazolidin-4-one (PubChem CID 59884171) has the molecular formula C15H16N2O and a molecular weight of 240.31 g/mol. Its IUPAC name is (5S)-3-methyl-5-(naphthalen-2-ylmethyl)imidazolidin-4-one.

Molecular Properties

Compound Name(5S)-3-methyl-5-(naphthalen-2-ylmethyl)imidazolidin-4-one
PubChem CID59884171
Molecular FormulaC15H16N2O
Molecular Weight240.31 g/mol
Exact Mass240.13
IUPAC Name(5S)-3-methyl-5-(naphthalen-2-ylmethyl)imidazolidin-4-one
SMILESCN1CN[C@@H](Cc2ccc3ccccc3c2)C1=O
InChIInChI=1S/C15H16N2O/c1-17-10-16-14(15(17)18)9-11-6-7-12-4-2-3-5-13(12)8-11/h2-8,14,16H,9-10H2,1H3/t14-/m0/s1
InChIKeyWMUHPDJMMFBUJL-AWEZNQCLSA-N
XLogP1.77
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (5S)-3-methyl-5-(naphthalen-2-ylmethyl)imidazolidin-4-one?
The IUPAC name of (5S)-3-methyl-5-(naphthalen-2-ylmethyl)imidazolidin-4-one (CID 59884171) is (5S)-3-methyl-5-(naphthalen-2-ylmethyl)imidazolidin-4-one.
What is the SMILES notation for (5S)-3-methyl-5-(naphthalen-2-ylmethyl)imidazolidin-4-one?
The canonical SMILES for (5S)-3-methyl-5-(naphthalen-2-ylmethyl)imidazolidin-4-one is CN1CN[C@@H](Cc2ccc3ccccc3c2)C1=O.
What is the InChIKey of (5S)-3-methyl-5-(naphthalen-2-ylmethyl)imidazolidin-4-one?
The InChIKey is WMUHPDJMMFBUJL-AWEZNQCLSA-N. The full InChI is InChI=1S/C15H16N2O/c1-17-10-16-14(15(17)18)9-11-6-7-12-4-2-3-5-13(12)8-11/h2-8,14,16H,9-10H2,1H3/t14-/m0/s1.
What are the key properties of (5S)-3-methyl-5-(naphthalen-2-ylmethyl)imidazolidin-4-one?
(5S)-3-methyl-5-(naphthalen-2-ylmethyl)imidazolidin-4-one has a molecular weight of 240.31 g/mol, XLogP of 1.77, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-3-methyl-5-(naphthalen-2-ylmethyl)imidazolidin-4-one is sourced from PubChem (CID 59884171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).