2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-[(2R)-1-methoxypropan-2-yl]acetamide

C12H19N3O3 — CID 135896977

IUPAC2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-[(2R)-1-methoxypropan-2-yl]acetamide
SMILESCOC[C@@H](C)NC(=O)Cc1c(C)nc(C)[nH]c1=O
InChIInChI=1S/C12H19N3O3/c1-7(6-18-4)13-11(16)5-10-8(2)14-9(3)15-12(10)17/h7H,5-6H2,1-4H3,(H,13,16)(H,14,15,17)/t7-/m1/s1
InChIKeyFGNKWSLUIQMPGN-SSDOTTSWSA-N
MW253.30 g/mol
LogP0.08
Rot. Bonds5

About 2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-[(2R)-1-methoxypropan-2-yl]acetamide

2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-[(2R)-1-methoxypropan-2-yl]acetamide (PubChem CID 135896977) has the molecular formula C12H19N3O3 and a molecular weight of 253.30 g/mol. Its IUPAC name is 2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-[(2R)-1-methoxypropan-2-yl]acetamide.

Molecular Properties

Compound Name2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-[(2R)-1-methoxypropan-2-yl]acetamide
PubChem CID135896977
Molecular FormulaC12H19N3O3
Molecular Weight253.30 g/mol
Exact Mass253.14
IUPAC Name2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-[(2R)-1-methoxypropan-2-yl]acetamide
SMILESCOC[C@@H](C)NC(=O)Cc1c(C)nc(C)[nH]c1=O
InChIInChI=1S/C12H19N3O3/c1-7(6-18-4)13-11(16)5-10-8(2)14-9(3)15-12(10)17/h7H,5-6H2,1-4H3,(H,13,16)(H,14,15,17)/t7-/m1/s1
InChIKeyFGNKWSLUIQMPGN-SSDOTTSWSA-N
XLogP0.08
TPSA84.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.30
LogP ≤ 50.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-(2-methylpropyl)acetamide
CID 135896886
2-ethyl-5-[2-[(3S)-3-methoxypyrrolidin-1-yl]-2-oxoethyl]-4-methyl-1H-pyrimidin-6-one
CID 136849634
2,4-dimethyl-5-[1-[2-(2,2,2-trifluoroethoxy)ethylamino]ethyl]-1H-pyrimidin-6-one
CID 136148420
5-[1-[2-(2,2-difluoroethoxy)ethylamino]ethyl]-2,4-dimethyl-1H-pyrimidin-6-one
CID 136852734
2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-(3-methylbutyl)acetamide
CID 135896967
2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-(2-morpholin-4-ylethyl)acetamide
CID 135896979
5-isopropyl-2-(methoxymethyl)-6-methylpyrimidin-4(3H)-one
CID 136064349
5-ethyl-2-(methoxymethyl)-4-methyl-1H-pyrimidin-6-one
CID 136140596
2-(ethoxymethyl)-5-ethyl-4-methyl-1H-pyrimidin-6-one
CID 136233877
2-butyl-4-methyl-5-(2-morpholin-4-yl-2-oxoethyl)-1H-pyrimidin-6-one
CID 170353550
3-(2-Methoxyethyl)-2-methyl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(3H)-one
CID 97619787
3-(2-Ethoxyethyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-one
CID 103483489

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-[(2R)-1-methoxypropan-2-yl]acetamide?
The IUPAC name of 2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-[(2R)-1-methoxypropan-2-yl]acetamide (CID 135896977) is 2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-[(2R)-1-methoxypropan-2-yl]acetamide.
What is the SMILES notation for 2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-[(2R)-1-methoxypropan-2-yl]acetamide?
The canonical SMILES for 2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-[(2R)-1-methoxypropan-2-yl]acetamide is COC[C@@H](C)NC(=O)Cc1c(C)nc(C)[nH]c1=O.
What is the InChIKey of 2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-[(2R)-1-methoxypropan-2-yl]acetamide?
The InChIKey is FGNKWSLUIQMPGN-SSDOTTSWSA-N. The full InChI is InChI=1S/C12H19N3O3/c1-7(6-18-4)13-11(16)5-10-8(2)14-9(3)15-12(10)17/h7H,5-6H2,1-4H3,(H,13,16)(H,14,15,17)/t7-/m1/s1.
What are the key properties of 2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-[(2R)-1-methoxypropan-2-yl]acetamide?
2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-[(2R)-1-methoxypropan-2-yl]acetamide has a molecular weight of 253.30 g/mol, XLogP of 0.08, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-[(2R)-1-methoxypropan-2-yl]acetamide is sourced from PubChem (CID 135896977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).