1-methyl-2-(4-methylmorpholin-3-yl)-6-oxopyrimidine-4-carboxamide

C11H16N4O3 — CID 141087183

IUPAC1-methyl-2-(4-methylmorpholin-3-yl)-6-oxopyrimidine-4-carboxamide
SMILESCN1CCOCC1c1nc(C(N)=O)cc(=O)n1C
InChIInChI=1S/C11H16N4O3/c1-14-3-4-18-6-8(14)11-13-7(10(12)17)5-9(16)15(11)2/h5,8H,3-4,6H2,1-2H3,(H2,12,17)
InChIKeyRWIKJYGZDUOWKA-UHFFFAOYSA-N
MW252.27 g/mol
LogP-1.12
Rot. Bonds2

About 1-methyl-2-(4-methylmorpholin-3-yl)-6-oxopyrimidine-4-carboxamide

1-methyl-2-(4-methylmorpholin-3-yl)-6-oxopyrimidine-4-carboxamide (PubChem CID 141087183) has the molecular formula C11H16N4O3 and a molecular weight of 252.27 g/mol. Its IUPAC name is 1-methyl-2-(4-methylmorpholin-3-yl)-6-oxopyrimidine-4-carboxamide.

Molecular Properties

Compound Name1-methyl-2-(4-methylmorpholin-3-yl)-6-oxopyrimidine-4-carboxamide
PubChem CID141087183
Molecular FormulaC11H16N4O3
Molecular Weight252.27 g/mol
Exact Mass252.12
IUPAC Name1-methyl-2-(4-methylmorpholin-3-yl)-6-oxopyrimidine-4-carboxamide
SMILESCN1CCOCC1c1nc(C(N)=O)cc(=O)n1C
InChIInChI=1S/C11H16N4O3/c1-14-3-4-18-6-8(14)11-13-7(10(12)17)5-9(16)15(11)2/h5,8H,3-4,6H2,1-2H3,(H2,12,17)
InChIKeyRWIKJYGZDUOWKA-UHFFFAOYSA-N
XLogP-1.12
TPSA90.45 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.27
LogP ≤ 5-1.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

(5z)-2-Ethyl-3-methyl-5-(morpholin-4-ylmethylidene)-3,5-dihydro-4h-imidazol-4-one
CID 154700627
2-Isopropyl-6-(morpholinomethyl)-4-pyrimidinol
CID 135486292
9,9-Dimethyl-4-oxo-6,7-dihydropyrimido[2,1-c][1,4]oxazine-2-carboxamide
CID 90770449
N,N-dimethyl-4-oxo-7,9-dihydro-6H-pyrimido[2,1-c][1,4]oxazine-2-carboxamide
CID 90871963
4-oxo-7,9-dihydro-6H-pyrimido[2,1-c][1,4]oxazine-2-carboxamide
CID 91135937
1-Methyl-2-(2-morpholin-4-ylethyl)-6-oxopyrimidine-4-carboxamide
CID 150229737
9-ethyl-4-oxo-7,9-dihydro-6H-pyrimido[2,1-c][1,4]oxazine-2-carboxamide
CID 151334078
4-Oxo-6,7,9,10-tetrahydropyrimido[1,2-d][1,4]oxazepine-2-carboxamide
CID 154512106
2,6-Dimethyl-3-(2-morpholin-4-yl-2-oxoethyl)pyrimidin-4-one
CID 7748970
2-(1-Aminoethyl)-3-methyl-6-morpholin-4-ylpyrimidin-4-one
CID 84700722
3-[3-Methoxy-2-(methylamino)propyl]-2,6-dimethylpyrimidin-4-one
CID 107506242
3-[2-(Ethylamino)-3-methoxypropyl]-2,6-dimethylpyrimidin-4-one
CID 107506243

Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-(4-methylmorpholin-3-yl)-6-oxopyrimidine-4-carboxamide?
The IUPAC name of 1-methyl-2-(4-methylmorpholin-3-yl)-6-oxopyrimidine-4-carboxamide (CID 141087183) is 1-methyl-2-(4-methylmorpholin-3-yl)-6-oxopyrimidine-4-carboxamide.
What is the SMILES notation for 1-methyl-2-(4-methylmorpholin-3-yl)-6-oxopyrimidine-4-carboxamide?
The canonical SMILES for 1-methyl-2-(4-methylmorpholin-3-yl)-6-oxopyrimidine-4-carboxamide is CN1CCOCC1c1nc(C(N)=O)cc(=O)n1C.
What is the InChIKey of 1-methyl-2-(4-methylmorpholin-3-yl)-6-oxopyrimidine-4-carboxamide?
The InChIKey is RWIKJYGZDUOWKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O3/c1-14-3-4-18-6-8(14)11-13-7(10(12)17)5-9(16)15(11)2/h5,8H,3-4,6H2,1-2H3,(H2,12,17).
What are the key properties of 1-methyl-2-(4-methylmorpholin-3-yl)-6-oxopyrimidine-4-carboxamide?
1-methyl-2-(4-methylmorpholin-3-yl)-6-oxopyrimidine-4-carboxamide has a molecular weight of 252.27 g/mol, XLogP of -1.12, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-(4-methylmorpholin-3-yl)-6-oxopyrimidine-4-carboxamide is sourced from PubChem (CID 141087183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).