5-benzyl-6-(4-phenylcyclohexyl)-1H-pyrimidine-2,4-dione

C23H24N2O2 — CID 60202645

IUPAC5-benzyl-6-(4-phenylcyclohexyl)-1H-pyrimidine-2,4-dione
SMILESC1CC(CCC1C2=CC=CC=C2)C3=C(C(=O)NC(=O)N3)CC4=CC=CC=C4
InChIInChI=1S/C23H24N2O2/c26-22-20(15-16-7-3-1-4-8-16)21(24-23(27)25-22)19-13-11-18(12-14-19)17-9-5-2-6-10-17/h1-10,18-19H,11-15H2,(H2,24,25,26,27)
InChIKeyVHLMQIRJBBXPBJ-UHFFFAOYSA-N
MW360.40 g/mol
LogP4.30
Rot. Bonds4

About 5-benzyl-6-(4-phenylcyclohexyl)-1H-pyrimidine-2,4-dione

5-benzyl-6-(4-phenylcyclohexyl)-1H-pyrimidine-2,4-dione (PubChem CID 60202645) has the molecular formula C23H24N2O2 and a molecular weight of 360.40 g/mol. Its IUPAC name is 5-benzyl-6-(4-phenylcyclohexyl)-1H-pyrimidine-2,4-dione.

Molecular Properties

Compound Name5-benzyl-6-(4-phenylcyclohexyl)-1H-pyrimidine-2,4-dione
PubChem CID60202645
Molecular FormulaC23H24N2O2
Molecular Weight360.40 g/mol
Exact Mass360.18
IUPAC Name5-benzyl-6-(4-phenylcyclohexyl)-1H-pyrimidine-2,4-dione
SMILESC1CC(CCC1C2=CC=CC=C2)C3=C(C(=O)NC(=O)N3)CC4=CC=CC=C4
InChIInChI=1S/C23H24N2O2/c26-22-20(15-16-7-3-1-4-8-16)21(24-23(27)25-22)19-13-11-18(12-14-19)17-9-5-2-6-10-17/h1-10,18-19H,11-15H2,(H2,24,25,26,27)
InChIKeyVHLMQIRJBBXPBJ-UHFFFAOYSA-N
XLogP4.30
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms27
Complexity577

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.40
LogP ≤ 54.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 5-benzyl-6-(4-phenylcyclohexyl)-1H-pyrimidine-2,4-dione with MolForge

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Related Compounds

Miricorilant
CID 66550324
5-benzyl-6-(4-benzylpiperidin-1-yl)-3-methylpyrimidine-2,4(1H,3H)-dione
CID 4193542
5-benzyl-6-(4-phenylpiperidin-1-yl)pyrimidine-2,4(1H,3H)-dione
CID 11530605
5-benzyl-3-methyl-6-(4-phenylpiperidin-1-yl)pyrimidine-2,4(1H,3H)-dione
CID 44426753
5-benzyl-6-(4-benzylpiperidin-1-yl)pyrimidine-2,4(1H,3H)-dione
CID 44426766
5-benzyl-3-methyl-6-(4-phenethylpiperidin-1-yl)pyrimidine-2,4(1H,3H)-dione
CID 44426775
5-benzyl-6-(3-phenylpiperidin-1-yl)pyrimidine-2,4(1H,3H)-dione
CID 44426796
5-benzyl-6-(3-phenylpyrrolidin-1-yl)pyrimidine-2,4(1H,3H)-dione
CID 44426797
5-[(2-ethylphenyl)methyl]-6-(4-phenylcyclohexyl)-1H-pyrimidine-2,4-dione
CID 66549685
5-[(2-chlorophenyl)methyl]-6-(4-phenylcyclohexyl)-1H-pyrimidine-2,4-dione
CID 66549686
5-[(2,3-dichlorophenyl)methyl]-6-(4-phenylcyclohexyl)-1H-pyrimidine-2,4-dione
CID 66549878
5-[(2,6-dichlorophenyl)methyl]-6-(4-phenylcyclohexyl)-1H-pyrimidine-2,4-dione
CID 66549879

Frequently Asked Questions

What is the IUPAC name of 5-benzyl-6-(4-phenylcyclohexyl)-1H-pyrimidine-2,4-dione?
The IUPAC name of 5-benzyl-6-(4-phenylcyclohexyl)-1H-pyrimidine-2,4-dione (CID 60202645) is 5-benzyl-6-(4-phenylcyclohexyl)-1H-pyrimidine-2,4-dione.
What is the SMILES notation for 5-benzyl-6-(4-phenylcyclohexyl)-1H-pyrimidine-2,4-dione?
The canonical SMILES for 5-benzyl-6-(4-phenylcyclohexyl)-1H-pyrimidine-2,4-dione is C1CC(CCC1C2=CC=CC=C2)C3=C(C(=O)NC(=O)N3)CC4=CC=CC=C4.
What is the InChIKey of 5-benzyl-6-(4-phenylcyclohexyl)-1H-pyrimidine-2,4-dione?
The InChIKey is VHLMQIRJBBXPBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O2/c26-22-20(15-16-7-3-1-4-8-16)21(24-23(27)25-22)19-13-11-18(12-14-19)17-9-5-2-6-10-17/h1-10,18-19H,11-15H2,(H2,24,25,26,27).
What are the key properties of 5-benzyl-6-(4-phenylcyclohexyl)-1H-pyrimidine-2,4-dione?
5-benzyl-6-(4-phenylcyclohexyl)-1H-pyrimidine-2,4-dione has a molecular weight of 360.40 g/mol, XLogP of 4.30, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-benzyl-6-(4-phenylcyclohexyl)-1H-pyrimidine-2,4-dione is sourced from PubChem (CID 60202645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).