6-amino-5-[2-[ethyl(2-phenylethyl)amino]acetyl]-1,3-dimethylpyrimidine-2,4-dione

C18H24N4O3 — CID 47056286

IUPAC6-amino-5-[2-[ethyl(2-phenylethyl)amino]acetyl]-1,3-dimethylpyrimidine-2,4-dione
SMILESCCN(CCc1ccccc1)CC(=O)c1c(N)n(C)c(=O)n(C)c1=O
InChIInChI=1S/C18H24N4O3/c1-4-22(11-10-13-8-6-5-7-9-13)12-14(23)15-16(19)20(2)18(25)21(3)17(15)24/h5-9H,4,10-12,19H2,1-3H3
InChIKeyRUSKFVKMGGTAPK-UHFFFAOYSA-N
MW344.42 g/mol
LogP0.41
Rot. Bonds7

About 6-amino-5-[2-[ethyl(2-phenylethyl)amino]acetyl]-1,3-dimethylpyrimidine-2,4-dione

6-amino-5-[2-[ethyl(2-phenylethyl)amino]acetyl]-1,3-dimethylpyrimidine-2,4-dione (PubChem CID 47056286) has the molecular formula C18H24N4O3 and a molecular weight of 344.42 g/mol. Its IUPAC name is 6-amino-5-[2-[ethyl(2-phenylethyl)amino]acetyl]-1,3-dimethylpyrimidine-2,4-dione.

Molecular Properties

Compound Name6-amino-5-[2-[ethyl(2-phenylethyl)amino]acetyl]-1,3-dimethylpyrimidine-2,4-dione
PubChem CID47056286
Molecular FormulaC18H24N4O3
Molecular Weight344.42 g/mol
Exact Mass344.18
IUPAC Name6-amino-5-[2-[ethyl(2-phenylethyl)amino]acetyl]-1,3-dimethylpyrimidine-2,4-dione
SMILESCCN(CCc1ccccc1)CC(=O)c1c(N)n(C)c(=O)n(C)c1=O
InChIInChI=1S/C18H24N4O3/c1-4-22(11-10-13-8-6-5-7-9-13)12-14(23)15-16(19)20(2)18(25)21(3)17(15)24/h5-9H,4,10-12,19H2,1-3H3
InChIKeyRUSKFVKMGGTAPK-UHFFFAOYSA-N
XLogP0.41
TPSA90.33 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.42
LogP ≤ 50.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

6-amino-5-[2-[(4-ethylphenyl)methyl-methylamino]acetyl]-1,3-dimethylpyrimidine-2,4-dione
CID 27206199
6-amino-1-benzyl-5-[2-(dimethylamino)acetyl]-3-methylpyrimidine-2,4-dione
CID 2568067
6-amino-5-[2-(2-methoxy-N-methylanilino)acetyl]-1,3-dimethylpyrimidine-2,4-dione
CID 47057162
6-amino-5-[2-[(3-chlorophenyl)methyl-methylamino]acetyl]-1,3-dimethylpyrimidine-2,4-dione
CID 27249624
6-amino-1-benzyl-3-methyl-5-[2-(N-methylanilino)acetyl]pyrimidine-2,4-dione
CID 2685169
6-amino-5-[(2R)-2-[benzyl(methyl)amino]propanoyl]-1,3-dimethylpyrimidine-2,4-dione
CID 27133743
6-amino-1-benzyl-5-[2-[cycloheptyl(methyl)amino]acetyl]-3-methylpyrimidine-2,4-dione
CID 16577799
6-amino-1-benzyl-5-[2-[(4-ethylphenyl)methyl-methylamino]acetyl]-3-methylpyrimidine-2,4-dione
CID 4793867
6-amino-1,3-dimethyl-5-[2-[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]acetyl]pyrimidine-2,4-dione
CID 27243240
6-amino-1-benzyl-3-ethyl-5-[2-[2-hydroxyethyl(propyl)amino]acetyl]pyrimidine-2,4-dione
CID 78820474
2-[[2-(4-amino-1-methyl-2,6-dioxo-3-propylpyrimidin-5-yl)-2-oxoethyl]-ethylamino]-N-ethylacetamide
CID 9433261
6-amino-1,3-dimethyl-5-[2-(4-phenylpiperidin-1-yl)acetyl]pyrimidine-2,4-dione
CID 55543694

Frequently Asked Questions

What is the IUPAC name of 6-amino-5-[2-[ethyl(2-phenylethyl)amino]acetyl]-1,3-dimethylpyrimidine-2,4-dione?
The IUPAC name of 6-amino-5-[2-[ethyl(2-phenylethyl)amino]acetyl]-1,3-dimethylpyrimidine-2,4-dione (CID 47056286) is 6-amino-5-[2-[ethyl(2-phenylethyl)amino]acetyl]-1,3-dimethylpyrimidine-2,4-dione.
What is the SMILES notation for 6-amino-5-[2-[ethyl(2-phenylethyl)amino]acetyl]-1,3-dimethylpyrimidine-2,4-dione?
The canonical SMILES for 6-amino-5-[2-[ethyl(2-phenylethyl)amino]acetyl]-1,3-dimethylpyrimidine-2,4-dione is CCN(CCc1ccccc1)CC(=O)c1c(N)n(C)c(=O)n(C)c1=O.
What is the InChIKey of 6-amino-5-[2-[ethyl(2-phenylethyl)amino]acetyl]-1,3-dimethylpyrimidine-2,4-dione?
The InChIKey is RUSKFVKMGGTAPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O3/c1-4-22(11-10-13-8-6-5-7-9-13)12-14(23)15-16(19)20(2)18(25)21(3)17(15)24/h5-9H,4,10-12,19H2,1-3H3.
What are the key properties of 6-amino-5-[2-[ethyl(2-phenylethyl)amino]acetyl]-1,3-dimethylpyrimidine-2,4-dione?
6-amino-5-[2-[ethyl(2-phenylethyl)amino]acetyl]-1,3-dimethylpyrimidine-2,4-dione has a molecular weight of 344.42 g/mol, XLogP of 0.41, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-5-[2-[ethyl(2-phenylethyl)amino]acetyl]-1,3-dimethylpyrimidine-2,4-dione is sourced from PubChem (CID 47056286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).