1-ethyl-3-methyl-4-naphthalen-2-ylimidazolidin-2-one

C16H18N2O — CID 116983099

IUPAC1-ethyl-3-methyl-4-naphthalen-2-ylimidazolidin-2-one
SMILESCCN1CC(c2ccc3ccccc3c2)N(C)C1=O
InChIInChI=1S/C16H18N2O/c1-3-18-11-15(17(2)16(18)19)14-9-8-12-6-4-5-7-13(12)10-14/h4-10,15H,3,11H2,1-2H3
InChIKeyNFKOSUZWWLDMPS-UHFFFAOYSA-N
MW254.33 g/mol
LogP3.27
Rot. Bonds2

About 1-ethyl-3-methyl-4-naphthalen-2-ylimidazolidin-2-one

1-ethyl-3-methyl-4-naphthalen-2-ylimidazolidin-2-one (PubChem CID 116983099) has the molecular formula C16H18N2O and a molecular weight of 254.33 g/mol. Its IUPAC name is 1-ethyl-3-methyl-4-naphthalen-2-ylimidazolidin-2-one.

Molecular Properties

Compound Name1-ethyl-3-methyl-4-naphthalen-2-ylimidazolidin-2-one
PubChem CID116983099
Molecular FormulaC16H18N2O
Molecular Weight254.33 g/mol
Exact Mass254.14
IUPAC Name1-ethyl-3-methyl-4-naphthalen-2-ylimidazolidin-2-one
SMILESCCN1CC(c2ccc3ccccc3c2)N(C)C1=O
InChIInChI=1S/C16H18N2O/c1-3-18-11-15(17(2)16(18)19)14-9-8-12-6-4-5-7-13(12)10-14/h4-10,15H,3,11H2,1-2H3
InChIKeyNFKOSUZWWLDMPS-UHFFFAOYSA-N
XLogP3.27
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 53.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-methyl-4-naphthalen-2-ylimidazolidin-2-one?
The IUPAC name of 1-ethyl-3-methyl-4-naphthalen-2-ylimidazolidin-2-one (CID 116983099) is 1-ethyl-3-methyl-4-naphthalen-2-ylimidazolidin-2-one.
What is the SMILES notation for 1-ethyl-3-methyl-4-naphthalen-2-ylimidazolidin-2-one?
The canonical SMILES for 1-ethyl-3-methyl-4-naphthalen-2-ylimidazolidin-2-one is CCN1CC(c2ccc3ccccc3c2)N(C)C1=O.
What is the InChIKey of 1-ethyl-3-methyl-4-naphthalen-2-ylimidazolidin-2-one?
The InChIKey is NFKOSUZWWLDMPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O/c1-3-18-11-15(17(2)16(18)19)14-9-8-12-6-4-5-7-13(12)10-14/h4-10,15H,3,11H2,1-2H3.
What are the key properties of 1-ethyl-3-methyl-4-naphthalen-2-ylimidazolidin-2-one?
1-ethyl-3-methyl-4-naphthalen-2-ylimidazolidin-2-one has a molecular weight of 254.33 g/mol, XLogP of 3.27, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-methyl-4-naphthalen-2-ylimidazolidin-2-one is sourced from PubChem (CID 116983099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).