(5R)-5-methyl-5-naphthalen-1-yl-3-(pyrrolidin-1-ylmethyl)imidazolidine-2,4-dione

C19H21N3O2 — CID 9403666

IUPAC(5R)-5-methyl-5-naphthalen-1-yl-3-(pyrrolidin-1-ylmethyl)imidazolidine-2,4-dione
SMILESC[C@]1(c2cccc3ccccc23)NC(=O)N(CN2CCCC2)C1=O
InChIInChI=1S/C19H21N3O2/c1-19(16-10-6-8-14-7-2-3-9-15(14)16)17(23)22(18(24)20-19)13-21-11-4-5-12-21/h2-3,6-10H,4-5,11-13H2,1H3,(H,20,24)/t19-/m1/s1
InChIKeyGREZPDVPPOBBIK-LJQANCHMSA-N
MW323.40 g/mol
LogP2.66
Rot. Bonds3

About (5R)-5-methyl-5-naphthalen-1-yl-3-(pyrrolidin-1-ylmethyl)imidazolidine-2,4-dione

(5R)-5-methyl-5-naphthalen-1-yl-3-(pyrrolidin-1-ylmethyl)imidazolidine-2,4-dione (PubChem CID 9403666) has the molecular formula C19H21N3O2 and a molecular weight of 323.40 g/mol. Its IUPAC name is (5R)-5-methyl-5-naphthalen-1-yl-3-(pyrrolidin-1-ylmethyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name(5R)-5-methyl-5-naphthalen-1-yl-3-(pyrrolidin-1-ylmethyl)imidazolidine-2,4-dione
PubChem CID9403666
Molecular FormulaC19H21N3O2
Molecular Weight323.40 g/mol
Exact Mass323.16
IUPAC Name(5R)-5-methyl-5-naphthalen-1-yl-3-(pyrrolidin-1-ylmethyl)imidazolidine-2,4-dione
SMILESC[C@]1(c2cccc3ccccc23)NC(=O)N(CN2CCCC2)C1=O
InChIInChI=1S/C19H21N3O2/c1-19(16-10-6-8-14-7-2-3-9-15(14)16)17(23)22(18(24)20-19)13-21-11-4-5-12-21/h2-3,6-10H,4-5,11-13H2,1H3,(H,20,24)/t19-/m1/s1
InChIKeyGREZPDVPPOBBIK-LJQANCHMSA-N
XLogP2.66
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.40
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (5R)-5-methyl-5-naphthalen-1-yl-3-(pyrrolidin-1-ylmethyl)imidazolidine-2,4-dione?
The IUPAC name of (5R)-5-methyl-5-naphthalen-1-yl-3-(pyrrolidin-1-ylmethyl)imidazolidine-2,4-dione (CID 9403666) is (5R)-5-methyl-5-naphthalen-1-yl-3-(pyrrolidin-1-ylmethyl)imidazolidine-2,4-dione.
What is the SMILES notation for (5R)-5-methyl-5-naphthalen-1-yl-3-(pyrrolidin-1-ylmethyl)imidazolidine-2,4-dione?
The canonical SMILES for (5R)-5-methyl-5-naphthalen-1-yl-3-(pyrrolidin-1-ylmethyl)imidazolidine-2,4-dione is C[C@]1(c2cccc3ccccc23)NC(=O)N(CN2CCCC2)C1=O.
What is the InChIKey of (5R)-5-methyl-5-naphthalen-1-yl-3-(pyrrolidin-1-ylmethyl)imidazolidine-2,4-dione?
The InChIKey is GREZPDVPPOBBIK-LJQANCHMSA-N. The full InChI is InChI=1S/C19H21N3O2/c1-19(16-10-6-8-14-7-2-3-9-15(14)16)17(23)22(18(24)20-19)13-21-11-4-5-12-21/h2-3,6-10H,4-5,11-13H2,1H3,(H,20,24)/t19-/m1/s1.
What are the key properties of (5R)-5-methyl-5-naphthalen-1-yl-3-(pyrrolidin-1-ylmethyl)imidazolidine-2,4-dione?
(5R)-5-methyl-5-naphthalen-1-yl-3-(pyrrolidin-1-ylmethyl)imidazolidine-2,4-dione has a molecular weight of 323.40 g/mol, XLogP of 2.66, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-methyl-5-naphthalen-1-yl-3-(pyrrolidin-1-ylmethyl)imidazolidine-2,4-dione is sourced from PubChem (CID 9403666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).