(5S)-2,2,3-trimethyl-5-(naphthalen-1-ylmethyl)imidazolidin-4-one

C17H20N2O — CID 59883933

IUPAC(5S)-2,2,3-trimethyl-5-(naphthalen-1-ylmethyl)imidazolidin-4-one
SMILESCN1C(=O)[C@H](Cc2cccc3ccccc23)NC1(C)C
InChIInChI=1S/C17H20N2O/c1-17(2)18-15(16(20)19(17)3)11-13-9-6-8-12-7-4-5-10-14(12)13/h4-10,15,18H,11H2,1-3H3/t15-/m0/s1
InChIKeySPNRLPVGLXOVDL-HNNXBMFYSA-N
MW268.36 g/mol
LogP2.55
Rot. Bonds2

About (5S)-2,2,3-trimethyl-5-(naphthalen-1-ylmethyl)imidazolidin-4-one

(5S)-2,2,3-trimethyl-5-(naphthalen-1-ylmethyl)imidazolidin-4-one (PubChem CID 59883933) has the molecular formula C17H20N2O and a molecular weight of 268.36 g/mol. Its IUPAC name is (5S)-2,2,3-trimethyl-5-(naphthalen-1-ylmethyl)imidazolidin-4-one.

Molecular Properties

Compound Name(5S)-2,2,3-trimethyl-5-(naphthalen-1-ylmethyl)imidazolidin-4-one
PubChem CID59883933
Molecular FormulaC17H20N2O
Molecular Weight268.36 g/mol
Exact Mass268.16
IUPAC Name(5S)-2,2,3-trimethyl-5-(naphthalen-1-ylmethyl)imidazolidin-4-one
SMILESCN1C(=O)[C@H](Cc2cccc3ccccc23)NC1(C)C
InChIInChI=1S/C17H20N2O/c1-17(2)18-15(16(20)19(17)3)11-13-9-6-8-12-7-4-5-10-14(12)13/h4-10,15,18H,11H2,1-3H3/t15-/m0/s1
InChIKeySPNRLPVGLXOVDL-HNNXBMFYSA-N
XLogP2.55
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(5S)-3-Benzyl-5-ethyl-5-phenylimidazolidine-2,4-dione
CID 40633600
(2S)-N-[(2S)-6-amino-1-[[(2S)-1-amino-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-1-oxohexan-2-yl]-1-(2-naphthalen-1-ylacetyl)pyrrolidine-2-carboxamide
CID 146257295
beta-phenyl-D-phenylalanyl-N-propyl-L-prolinamide
CID 25271577
N-(2-Aminoethyl)-1-naphthylacetamide hydrochloride
CID 3056271
(2S,3S)-1-[(3S)-3-fluoropyrrolidin-1-yl]-3-[4-(2-methylphenyl)phenyl]-1-oxobutan-2-aminium; 2,2,2-trifluoroacetate
CID 91895821
3-Benzyl-5-ethyl-5-phenylimidazolidine-2,4-dione
CID 4804492
(2R)-N'-hydroxy-N-[(2R)-1-(methylamino)-3-naphthalen-1-yl-1-oxopropan-2-yl]-2-(2-methylpropyl)butanediamide
CID 44310921
[(1R)-1-[[(2S)-2-acetamido-3-naphthalen-1-ylpropanoyl]amino]-3-methylbutyl]boronic acid
CID 44583187
(S)-N-(3-(4-(3-aminopropylamino)butylamino)propyl)-3-cyclohexyl-2-(2-(naphthalen-1-yl)acetamido)propanamide
CID 49788731
2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-methylacetamide
CID 2091432
N-butan-2-yl-2-(2',5'-dioxospiro[2,4-dihydro-1H-naphthalene-3,4'-imidazolidine]-1'-yl)acetamide
CID 4004542
2-(4-Methyl-4-naphthalen-2-yl-2,5-dioxoimidazolidin-1-yl)acetamide
CID 4463142

Frequently Asked Questions

What is the IUPAC name of (5S)-2,2,3-trimethyl-5-(naphthalen-1-ylmethyl)imidazolidin-4-one?
The IUPAC name of (5S)-2,2,3-trimethyl-5-(naphthalen-1-ylmethyl)imidazolidin-4-one (CID 59883933) is (5S)-2,2,3-trimethyl-5-(naphthalen-1-ylmethyl)imidazolidin-4-one.
What is the SMILES notation for (5S)-2,2,3-trimethyl-5-(naphthalen-1-ylmethyl)imidazolidin-4-one?
The canonical SMILES for (5S)-2,2,3-trimethyl-5-(naphthalen-1-ylmethyl)imidazolidin-4-one is CN1C(=O)[C@H](Cc2cccc3ccccc23)NC1(C)C.
What is the InChIKey of (5S)-2,2,3-trimethyl-5-(naphthalen-1-ylmethyl)imidazolidin-4-one?
The InChIKey is SPNRLPVGLXOVDL-HNNXBMFYSA-N. The full InChI is InChI=1S/C17H20N2O/c1-17(2)18-15(16(20)19(17)3)11-13-9-6-8-12-7-4-5-10-14(12)13/h4-10,15,18H,11H2,1-3H3/t15-/m0/s1.
What are the key properties of (5S)-2,2,3-trimethyl-5-(naphthalen-1-ylmethyl)imidazolidin-4-one?
(5S)-2,2,3-trimethyl-5-(naphthalen-1-ylmethyl)imidazolidin-4-one has a molecular weight of 268.36 g/mol, XLogP of 2.55, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-2,2,3-trimethyl-5-(naphthalen-1-ylmethyl)imidazolidin-4-one is sourced from PubChem (CID 59883933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).