4-amino-2-methyl-5-[2-[(2S,6R)-2-methyl-6-phenylmorpholin-4-yl]-2-oxoethyl]-1H-pyrimidin-6-one

C18H22N4O3 — CID 136790529

IUPAC4-amino-2-methyl-5-[2-[(2S,6R)-2-methyl-6-phenylmorpholin-4-yl]-2-oxoethyl]-1H-pyrimidin-6-one
SMILESCc1nc(N)c(CC(=O)N2C[C@@H](c3ccccc3)O[C@@H](C)C2)c(=O)[nH]1
InChIInChI=1S/C18H22N4O3/c1-11-9-22(10-15(25-11)13-6-4-3-5-7-13)16(23)8-14-17(19)20-12(2)21-18(14)24/h3-7,11,15H,8-10H2,1-2H3,(H3,19,20,21,24)/t11-,15-/m0/s1
InChIKeySOGLAMCCWNQBCZ-NHYWBVRUSA-N
MW342.40 g/mol
LogP1.19
Rot. Bonds3

About 4-amino-2-methyl-5-[2-[(2S,6R)-2-methyl-6-phenylmorpholin-4-yl]-2-oxoethyl]-1H-pyrimidin-6-one

4-amino-2-methyl-5-[2-[(2S,6R)-2-methyl-6-phenylmorpholin-4-yl]-2-oxoethyl]-1H-pyrimidin-6-one (PubChem CID 136790529) has the molecular formula C18H22N4O3 and a molecular weight of 342.40 g/mol. Its IUPAC name is 4-amino-2-methyl-5-[2-[(2S,6R)-2-methyl-6-phenylmorpholin-4-yl]-2-oxoethyl]-1H-pyrimidin-6-one.

Molecular Properties

Compound Name4-amino-2-methyl-5-[2-[(2S,6R)-2-methyl-6-phenylmorpholin-4-yl]-2-oxoethyl]-1H-pyrimidin-6-one
PubChem CID136790529
Molecular FormulaC18H22N4O3
Molecular Weight342.40 g/mol
Exact Mass342.17
IUPAC Name4-amino-2-methyl-5-[2-[(2S,6R)-2-methyl-6-phenylmorpholin-4-yl]-2-oxoethyl]-1H-pyrimidin-6-one
SMILESCc1nc(N)c(CC(=O)N2C[C@@H](c3ccccc3)O[C@@H](C)C2)c(=O)[nH]1
InChIInChI=1S/C18H22N4O3/c1-11-9-22(10-15(25-11)13-6-4-3-5-7-13)16(23)8-14-17(19)20-12(2)21-18(14)24/h3-7,11,15H,8-10H2,1-2H3,(H3,19,20,21,24)/t11-,15-/m0/s1
InChIKeySOGLAMCCWNQBCZ-NHYWBVRUSA-N
XLogP1.19
TPSA101.31 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-amino-2-methyl-5-[2-[(2S,6R)-2-methyl-6-phenylmorpholin-4-yl]-2-oxoethyl]-1H-pyrimidin-6-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,4-dimethyl-5-[2-[(2R,6S)-2-methyl-6-phenylmorpholin-4-yl]-2-oxoethyl]-1H-pyrimidin-6-one
CID 136903624
1-[(2R,6S)-2-methyl-6-phenylmorpholin-4-yl]-2-(2-methyl-1,3-thiazol-4-yl)ethanone
CID 95583764
1-[(2R,6R)-2-methyl-6-phenylmorpholin-4-yl]-2-(2-methyl-1,3-thiazol-4-yl)ethanone
CID 95583762
3-(3,5-dimethyl-1H-pyrazol-4-yl)-1-(2-methyl-6-phenylmorpholin-4-yl)propan-1-one
CID 146086488
1-(2-methyl-6-phenylmorpholin-4-yl)-2-phenoxyethanone
CID 47914743
5,5-dimethyl-1-[2-[(2R,6S)-2-methyl-6-phenylmorpholin-4-yl]-2-oxoethyl]imidazolidine-2,4-dione
CID 95772464
5-methyl-4-[2-oxo-2-[(2R,6S)-2-phenyl-6-propan-2-ylmorpholin-4-yl]ethyl]-1,2-dihydropyrazol-3-one
CID 155911907
3-(5-chloro-3-methyl-1,2-oxazol-4-yl)-1-[(2S,6S)-2-methyl-6-phenylmorpholin-4-yl]propan-1-one
CID 95590971
2,4-dimethyl-5-[3-oxo-3-[(2R)-2-phenylmorpholin-4-yl]propyl]-1H-pyrimidin-6-one
CID 136882935
1-(2-methyl-6-phenylmorpholin-4-yl)-3-piperidin-4-ylbutan-1-one
CID 119751371
2-(4-fluorophenyl)-1-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]ethanone
CID 110369198
(2-methyl-6-phenylmorpholin-4-yl)-phenylmethanone
CID 47914795

Frequently Asked Questions

What is the IUPAC name of 4-amino-2-methyl-5-[2-[(2S,6R)-2-methyl-6-phenylmorpholin-4-yl]-2-oxoethyl]-1H-pyrimidin-6-one?
The IUPAC name of 4-amino-2-methyl-5-[2-[(2S,6R)-2-methyl-6-phenylmorpholin-4-yl]-2-oxoethyl]-1H-pyrimidin-6-one (CID 136790529) is 4-amino-2-methyl-5-[2-[(2S,6R)-2-methyl-6-phenylmorpholin-4-yl]-2-oxoethyl]-1H-pyrimidin-6-one.
What is the SMILES notation for 4-amino-2-methyl-5-[2-[(2S,6R)-2-methyl-6-phenylmorpholin-4-yl]-2-oxoethyl]-1H-pyrimidin-6-one?
The canonical SMILES for 4-amino-2-methyl-5-[2-[(2S,6R)-2-methyl-6-phenylmorpholin-4-yl]-2-oxoethyl]-1H-pyrimidin-6-one is Cc1nc(N)c(CC(=O)N2C[C@@H](c3ccccc3)O[C@@H](C)C2)c(=O)[nH]1.
What is the InChIKey of 4-amino-2-methyl-5-[2-[(2S,6R)-2-methyl-6-phenylmorpholin-4-yl]-2-oxoethyl]-1H-pyrimidin-6-one?
The InChIKey is SOGLAMCCWNQBCZ-NHYWBVRUSA-N. The full InChI is InChI=1S/C18H22N4O3/c1-11-9-22(10-15(25-11)13-6-4-3-5-7-13)16(23)8-14-17(19)20-12(2)21-18(14)24/h3-7,11,15H,8-10H2,1-2H3,(H3,19,20,21,24)/t11-,15-/m0/s1.
What are the key properties of 4-amino-2-methyl-5-[2-[(2S,6R)-2-methyl-6-phenylmorpholin-4-yl]-2-oxoethyl]-1H-pyrimidin-6-one?
4-amino-2-methyl-5-[2-[(2S,6R)-2-methyl-6-phenylmorpholin-4-yl]-2-oxoethyl]-1H-pyrimidin-6-one has a molecular weight of 342.40 g/mol, XLogP of 1.19, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-2-methyl-5-[2-[(2S,6R)-2-methyl-6-phenylmorpholin-4-yl]-2-oxoethyl]-1H-pyrimidin-6-one is sourced from PubChem (CID 136790529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).