2,4-dimethyl-N-(2-morpholin-4-ylethyl)-6-oxo-1H-pyrimidine-5-carboxamide

C13H20N4O3 — CID 136911221

IUPAC2,4-dimethyl-N-(2-morpholin-4-ylethyl)-6-oxo-1H-pyrimidine-5-carboxamide
SMILESCc1nc(C)c(C(=O)NCCN2CCOCC2)c(=O)[nH]1
InChIInChI=1S/C13H20N4O3/c1-9-11(13(19)16-10(2)15-9)12(18)14-3-4-17-5-7-20-8-6-17/h3-8H2,1-2H3,(H,14,18)(H,15,16,19)
InChIKeyVOUIYYVTBXRIST-UHFFFAOYSA-N
MW280.33 g/mol
LogP-0.55
Rot. Bonds4

About 2,4-dimethyl-N-(2-morpholin-4-ylethyl)-6-oxo-1H-pyrimidine-5-carboxamide

2,4-dimethyl-N-(2-morpholin-4-ylethyl)-6-oxo-1H-pyrimidine-5-carboxamide (PubChem CID 136911221) has the molecular formula C13H20N4O3 and a molecular weight of 280.33 g/mol. Its IUPAC name is 2,4-dimethyl-N-(2-morpholin-4-ylethyl)-6-oxo-1H-pyrimidine-5-carboxamide.

Molecular Properties

Compound Name2,4-dimethyl-N-(2-morpholin-4-ylethyl)-6-oxo-1H-pyrimidine-5-carboxamide
PubChem CID136911221
Molecular FormulaC13H20N4O3
Molecular Weight280.33 g/mol
Exact Mass280.15
IUPAC Name2,4-dimethyl-N-(2-morpholin-4-ylethyl)-6-oxo-1H-pyrimidine-5-carboxamide
SMILESCc1nc(C)c(C(=O)NCCN2CCOCC2)c(=O)[nH]1
InChIInChI=1S/C13H20N4O3/c1-9-11(13(19)16-10(2)15-9)12(18)14-3-4-17-5-7-20-8-6-17/h3-8H2,1-2H3,(H,14,18)(H,15,16,19)
InChIKeyVOUIYYVTBXRIST-UHFFFAOYSA-N
XLogP-0.55
TPSA87.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 5-0.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-(2-morpholin-4-ylethyl)acetamide
CID 135896979
2,3-dimethyl-6-(3-morpholinylacetyl)-3,5,6,7-tetrahydro-4H-pyrrolo[3,4-d]pyrimidin-4-one
CID 56910816
N-{3-[(2R*,6S*)-2,6-dimethylmorpholin-4-yl]propyl}-4-hydroxy-2-methylpyrimidine-5-carboxamide
CID 72904643
2-isopropyl-5-{[4-(2-methoxyethyl)piperazin-1-yl]carbonyl}pyrimidin-4(3H)-one
CID 91839408
2,3-dimethyl-6-[2-[(3R)-morpholin-3-yl]acetyl]-5,7-dihydropyrrolo[3,4-d]pyrimidin-4-one
CID 95725994
2,3-dimethyl-6-[2-[(3S)-morpholin-3-yl]acetyl]-5,7-dihydropyrrolo[3,4-d]pyrimidin-4-one
CID 95725995
3-(2-Methoxyethyl)-2-methyl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(3H)-one
CID 97619787
4-[2-(2-hydroxyethylamino)ethylamino]-6-methyl-5-(4-methylpiperazine-1-carbonyl)-1H-pyrimidin-2-one
CID 101627392
2-methyl-5-(morpholine-4-carbonyl)-1H-pyrimidin-6-one
CID 110849406
N-(2-morpholin-4-ylethyl)-6-oxo-1H-pyrimidine-5-carboxamide
CID 110849732
2-methyl-N-(2-morpholin-4-ylethyl)-6-oxo-1H-pyrimidine-5-carboxamide
CID 110849733
2-(2-morpholin-4-yl-2-oxoethyl)-5,6,7,8-tetrahydro-3H-pyrimido[5,4-e][1,4]diazepine-4,9-dione
CID 135697216

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-N-(2-morpholin-4-ylethyl)-6-oxo-1H-pyrimidine-5-carboxamide?
The IUPAC name of 2,4-dimethyl-N-(2-morpholin-4-ylethyl)-6-oxo-1H-pyrimidine-5-carboxamide (CID 136911221) is 2,4-dimethyl-N-(2-morpholin-4-ylethyl)-6-oxo-1H-pyrimidine-5-carboxamide.
What is the SMILES notation for 2,4-dimethyl-N-(2-morpholin-4-ylethyl)-6-oxo-1H-pyrimidine-5-carboxamide?
The canonical SMILES for 2,4-dimethyl-N-(2-morpholin-4-ylethyl)-6-oxo-1H-pyrimidine-5-carboxamide is Cc1nc(C)c(C(=O)NCCN2CCOCC2)c(=O)[nH]1.
What is the InChIKey of 2,4-dimethyl-N-(2-morpholin-4-ylethyl)-6-oxo-1H-pyrimidine-5-carboxamide?
The InChIKey is VOUIYYVTBXRIST-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O3/c1-9-11(13(19)16-10(2)15-9)12(18)14-3-4-17-5-7-20-8-6-17/h3-8H2,1-2H3,(H,14,18)(H,15,16,19).
What are the key properties of 2,4-dimethyl-N-(2-morpholin-4-ylethyl)-6-oxo-1H-pyrimidine-5-carboxamide?
2,4-dimethyl-N-(2-morpholin-4-ylethyl)-6-oxo-1H-pyrimidine-5-carboxamide has a molecular weight of 280.33 g/mol, XLogP of -0.55, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-N-(2-morpholin-4-ylethyl)-6-oxo-1H-pyrimidine-5-carboxamide is sourced from PubChem (CID 136911221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).