1-[4-(4-propan-2-ylphenyl)phenyl]-1,3-diazinane-2,4-dione

C19H20N2O2 — CID 167923462

IUPAC1-[4-(4-propan-2-ylphenyl)phenyl]-1,3-diazinane-2,4-dione
SMILESCC(C)c1ccc(-c2ccc(N3CCC(=O)NC3=O)cc2)cc1
InChIInChI=1S/C19H20N2O2/c1-13(2)14-3-5-15(6-4-14)16-7-9-17(10-8-16)21-12-11-18(22)20-19(21)23/h3-10,13H,11-12H2,1-2H3,(H,20,22,23)
InChIKeyIXZNLDGFJUZWKB-UHFFFAOYSA-N
MW308.38 g/mol
LogP3.92
Rot. Bonds3

About 1-[4-(4-propan-2-ylphenyl)phenyl]-1,3-diazinane-2,4-dione

1-[4-(4-propan-2-ylphenyl)phenyl]-1,3-diazinane-2,4-dione (PubChem CID 167923462) has the molecular formula C19H20N2O2 and a molecular weight of 308.38 g/mol. Its IUPAC name is 1-[4-(4-propan-2-ylphenyl)phenyl]-1,3-diazinane-2,4-dione.

Molecular Properties

Compound Name1-[4-(4-propan-2-ylphenyl)phenyl]-1,3-diazinane-2,4-dione
PubChem CID167923462
Molecular FormulaC19H20N2O2
Molecular Weight308.38 g/mol
Exact Mass308.15
IUPAC Name1-[4-(4-propan-2-ylphenyl)phenyl]-1,3-diazinane-2,4-dione
SMILESCC(C)c1ccc(-c2ccc(N3CCC(=O)NC3=O)cc2)cc1
InChIInChI=1S/C19H20N2O2/c1-13(2)14-3-5-15(6-4-14)16-7-9-17(10-8-16)21-12-11-18(22)20-19(21)23/h3-10,13H,11-12H2,1-2H3,(H,20,22,23)
InChIKeyIXZNLDGFJUZWKB-UHFFFAOYSA-N
XLogP3.92
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[1-(4-propan-2-ylphenyl)triazol-4-yl]-1,3-diazinane-2,4-dione
CID 177356043
1-(4-iodophenyl)-1,3-diazinane-2,4-dione
CID 73172247
1-[2,4-di(propan-2-yl)phenyl]-1,3-diazinane-2,4-dione
CID 167282782
1-(4-methyliodanuidylphenyl)-1,3-diazinane-2,4-dione
CID 156707562
3-propan-2-yl-1-(4-propan-2-ylphenyl)-1,4-diazepane-2,5-dione
CID 64956447
1-(4-methylsulfonylphenyl)-1,3-diazinane-2,4-dione
CID 177010511
1-[4-(2,3-dihydro-1H-indol-5-yl)phenyl]-1,3-diazinane-2,4-dione
CID 167776784
4-(2,4-dioxo-1,3-diazinan-1-yl)benzamide
CID 23023749
ethane;1-[2-[methyl-(methylideneamino)amino]-4-propan-2-ylphenyl]-1,3-diazinane-2,4-dione
CID 177048685
1-[4-[3-(dimethoxymethyl)azetidin-1-yl]phenyl]-1,3-diazinane-2,4-dione
CID 176705955
4-methylidene-1-(4-propan-2-ylphenyl)piperidin-2-one
CID 167627647
1-[4-(2-hydroxyethyl)phenyl]-1,3-diazinane-2,4-dione
CID 166947284

Frequently Asked Questions

What is the IUPAC name of 1-[4-(4-propan-2-ylphenyl)phenyl]-1,3-diazinane-2,4-dione?
The IUPAC name of 1-[4-(4-propan-2-ylphenyl)phenyl]-1,3-diazinane-2,4-dione (CID 167923462) is 1-[4-(4-propan-2-ylphenyl)phenyl]-1,3-diazinane-2,4-dione.
What is the SMILES notation for 1-[4-(4-propan-2-ylphenyl)phenyl]-1,3-diazinane-2,4-dione?
The canonical SMILES for 1-[4-(4-propan-2-ylphenyl)phenyl]-1,3-diazinane-2,4-dione is CC(C)c1ccc(-c2ccc(N3CCC(=O)NC3=O)cc2)cc1.
What is the InChIKey of 1-[4-(4-propan-2-ylphenyl)phenyl]-1,3-diazinane-2,4-dione?
The InChIKey is IXZNLDGFJUZWKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O2/c1-13(2)14-3-5-15(6-4-14)16-7-9-17(10-8-16)21-12-11-18(22)20-19(21)23/h3-10,13H,11-12H2,1-2H3,(H,20,22,23).
What are the key properties of 1-[4-(4-propan-2-ylphenyl)phenyl]-1,3-diazinane-2,4-dione?
1-[4-(4-propan-2-ylphenyl)phenyl]-1,3-diazinane-2,4-dione has a molecular weight of 308.38 g/mol, XLogP of 3.92, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(4-propan-2-ylphenyl)phenyl]-1,3-diazinane-2,4-dione is sourced from PubChem (CID 167923462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).