3-[2-[[(2R)-1-(2-methylphenyl)propan-2-yl]amino]ethyl]imidazolidine-2,4-dione

C15H21N3O2 — CID 99639251

IUPAC3-[2-[[(2R)-1-(2-methylphenyl)propan-2-yl]amino]ethyl]imidazolidine-2,4-dione
SMILESCc1ccccc1C[C@@H](C)NCCN1C(=O)CNC1=O
InChIInChI=1S/C15H21N3O2/c1-11-5-3-4-6-13(11)9-12(2)16-7-8-18-14(19)10-17-15(18)20/h3-6,12,16H,7-10H2,1-2H3,(H,17,20)/t12-/m1/s1
InChIKeyPEQKYWPXCYEPTJ-GFCCVEGCSA-N
MW275.35 g/mol
LogP1.07
Rot. Bonds6

About 3-[2-[[(2R)-1-(2-methylphenyl)propan-2-yl]amino]ethyl]imidazolidine-2,4-dione

3-[2-[[(2R)-1-(2-methylphenyl)propan-2-yl]amino]ethyl]imidazolidine-2,4-dione (PubChem CID 99639251) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is 3-[2-[[(2R)-1-(2-methylphenyl)propan-2-yl]amino]ethyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name3-[2-[[(2R)-1-(2-methylphenyl)propan-2-yl]amino]ethyl]imidazolidine-2,4-dione
PubChem CID99639251
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC Name3-[2-[[(2R)-1-(2-methylphenyl)propan-2-yl]amino]ethyl]imidazolidine-2,4-dione
SMILESCc1ccccc1C[C@@H](C)NCCN1C(=O)CNC1=O
InChIInChI=1S/C15H21N3O2/c1-11-5-3-4-6-13(11)9-12(2)16-7-8-18-14(19)10-17-15(18)20/h3-6,12,16H,7-10H2,1-2H3,(H,17,20)/t12-/m1/s1
InChIKeyPEQKYWPXCYEPTJ-GFCCVEGCSA-N
XLogP1.07
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-[2-[[(2R)-1-pyrazol-1-ylpropan-2-yl]amino]ethyl]imidazolidine-2,4-dione
CID 95611974
3-[3-[1-(2-chlorophenyl)ethylamino]propyl]imidazolidine-2,4-dione
CID 56819750
N-ethyl-1-(2-methylphenyl)propan-2-amine
CID 14025646
3-[2-(2-bromophenyl)ethyl]imidazolidine-2,4-dione
CID 71559461
N'-tert-butyl-N-[1-(2-methylphenyl)propan-2-yl]ethane-1,2-diamine
CID 107445356
(2S,3R)-N-[2-(2,5-dioxoimidazolidin-1-yl)ethyl]-3-methyl-2-phenylpentanamide
CID 95339120
(2S)-N-(3-imidazol-1-ylpropyl)-1-(2-methylphenyl)propan-2-amine
CID 97228959
N-[2-(2,5-dioxoimidazolidin-1-yl)ethyl]-2-phenylacetamide
CID 110719095
(2,3-dimethylphenyl) 4-(2,5-dioxoimidazolidin-1-yl)butanoate
CID 87011719
2,2-dimethyl-N-[1-(2-methylphenyl)propan-2-yl]propan-1-amine
CID 61325570
4-[(2,5-dioxoimidazolidin-1-yl)methyl]-N-[(2-methylphenyl)methyl]benzamide
CID 17485480
N-[2-(2-methoxyphenyl)ethyl]-1-(2-methylphenyl)propan-2-amine
CID 57276686

Frequently Asked Questions

What is the IUPAC name of 3-[2-[[(2R)-1-(2-methylphenyl)propan-2-yl]amino]ethyl]imidazolidine-2,4-dione?
The IUPAC name of 3-[2-[[(2R)-1-(2-methylphenyl)propan-2-yl]amino]ethyl]imidazolidine-2,4-dione (CID 99639251) is 3-[2-[[(2R)-1-(2-methylphenyl)propan-2-yl]amino]ethyl]imidazolidine-2,4-dione.
What is the SMILES notation for 3-[2-[[(2R)-1-(2-methylphenyl)propan-2-yl]amino]ethyl]imidazolidine-2,4-dione?
The canonical SMILES for 3-[2-[[(2R)-1-(2-methylphenyl)propan-2-yl]amino]ethyl]imidazolidine-2,4-dione is Cc1ccccc1C[C@@H](C)NCCN1C(=O)CNC1=O.
What is the InChIKey of 3-[2-[[(2R)-1-(2-methylphenyl)propan-2-yl]amino]ethyl]imidazolidine-2,4-dione?
The InChIKey is PEQKYWPXCYEPTJ-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H21N3O2/c1-11-5-3-4-6-13(11)9-12(2)16-7-8-18-14(19)10-17-15(18)20/h3-6,12,16H,7-10H2,1-2H3,(H,17,20)/t12-/m1/s1.
What are the key properties of 3-[2-[[(2R)-1-(2-methylphenyl)propan-2-yl]amino]ethyl]imidazolidine-2,4-dione?
3-[2-[[(2R)-1-(2-methylphenyl)propan-2-yl]amino]ethyl]imidazolidine-2,4-dione has a molecular weight of 275.35 g/mol, XLogP of 1.07, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-[[(2R)-1-(2-methylphenyl)propan-2-yl]amino]ethyl]imidazolidine-2,4-dione is sourced from PubChem (CID 99639251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).