2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-(3-morpholin-4-ylpropyl)acetamide

C15H24N4O3 — CID 135896980

IUPAC2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-(3-morpholin-4-ylpropyl)acetamide
SMILESCc1nc(C)c(CC(=O)NCCCN2CCOCC2)c(=O)[nH]1
InChIInChI=1S/C15H24N4O3/c1-11-13(15(21)18-12(2)17-11)10-14(20)16-4-3-5-19-6-8-22-9-7-19/h3-10H2,1-2H3,(H,16,20)(H,17,18,21)
InChIKeyNHKIRKJXSBECJC-UHFFFAOYSA-N
MW308.38 g/mol
LogP-0.23
Rot. Bonds6

About 2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-(3-morpholin-4-ylpropyl)acetamide

2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-(3-morpholin-4-ylpropyl)acetamide (PubChem CID 135896980) has the molecular formula C15H24N4O3 and a molecular weight of 308.38 g/mol. Its IUPAC name is 2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-(3-morpholin-4-ylpropyl)acetamide.

Molecular Properties

Compound Name2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-(3-morpholin-4-ylpropyl)acetamide
PubChem CID135896980
Molecular FormulaC15H24N4O3
Molecular Weight308.38 g/mol
Exact Mass308.18
IUPAC Name2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-(3-morpholin-4-ylpropyl)acetamide
SMILESCc1nc(C)c(CC(=O)NCCCN2CCOCC2)c(=O)[nH]1
InChIInChI=1S/C15H24N4O3/c1-11-13(15(21)18-12(2)17-11)10-14(20)16-4-3-5-19-6-8-22-9-7-19/h3-10H2,1-2H3,(H,16,20)(H,17,18,21)
InChIKeyNHKIRKJXSBECJC-UHFFFAOYSA-N
XLogP-0.23
TPSA87.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 5-0.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

ethyl 4-[2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)acetyl]piperazine-1-carboxylate
CID 135896960
2,6-dimethyl-5-{2-oxo-2-[2-(trifluoromethyl)morpholin-4-yl]ethyl}pyrimidin-4(3H)-one
CID 136147249
5-(1,1-difluoro-2-morpholin-4-yl-2-oxoethyl)-4-methyl-2-propan-2-yl-1H-pyrimidin-6-one
CID 137295740
N-methyl-2-morpholin-4-yl-4-oxo-5,6,8,9-tetrahydro-3H-pyrimido[4,5-d]azepine-7-carboxamide
CID 136665473
N-(2-Methoxyethyl)-2-(4-methylpiperazin-1-YL)-4-oxo-3H,4H,5H,6H,7H,8H,9H-pyrimido[4,5-D]azepine-7-carboxamide
CID 136665475
2-ethyl-6-methyl-5-{2-oxo-2-[2-(trifluoromethyl)morpholin-4-yl]ethyl}pyrimidin-4(3H)-one
CID 136015656
2,4-dimethyl-5-[2-oxo-2-[(2S)-2-(trifluoromethyl)morpholin-4-yl]ethyl]-1H-pyrimidin-6-one
CID 136858381
2,4-dimethyl-5-[2-oxo-2-[(2R)-2-(trifluoromethyl)morpholin-4-yl]ethyl]-1H-pyrimidin-6-one
CID 136858382
2-ethyl-4-methyl-5-[2-oxo-2-[(2S)-2-(trifluoromethyl)morpholin-4-yl]ethyl]-1H-pyrimidin-6-one
CID 136883852
2-ethyl-4-methyl-5-[2-oxo-2-[(2R)-2-(trifluoromethyl)morpholin-4-yl]ethyl]-1H-pyrimidin-6-one
CID 136883853
2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-(2-morpholin-4-ylethyl)acetamide
CID 135896979
3-ethyl-4-oxo-7,9-dihydro-6H-pyrimido[2,1-c][1,4]oxazine-2-carboxamide
CID 145791178

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-(3-morpholin-4-ylpropyl)acetamide?
The IUPAC name of 2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-(3-morpholin-4-ylpropyl)acetamide (CID 135896980) is 2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-(3-morpholin-4-ylpropyl)acetamide.
What is the SMILES notation for 2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-(3-morpholin-4-ylpropyl)acetamide?
The canonical SMILES for 2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-(3-morpholin-4-ylpropyl)acetamide is Cc1nc(C)c(CC(=O)NCCCN2CCOCC2)c(=O)[nH]1.
What is the InChIKey of 2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-(3-morpholin-4-ylpropyl)acetamide?
The InChIKey is NHKIRKJXSBECJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O3/c1-11-13(15(21)18-12(2)17-11)10-14(20)16-4-3-5-19-6-8-22-9-7-19/h3-10H2,1-2H3,(H,16,20)(H,17,18,21).
What are the key properties of 2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-(3-morpholin-4-ylpropyl)acetamide?
2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-(3-morpholin-4-ylpropyl)acetamide has a molecular weight of 308.38 g/mol, XLogP of -0.23, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-(3-morpholin-4-ylpropyl)acetamide is sourced from PubChem (CID 135896980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).