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

C10H15N3O3 — CID 136911216

IUPACN-(2-methoxyethyl)-2,4-dimethyl-6-oxo-1H-pyrimidine-5-carboxamide
SMILESCOCCNC(=O)c1c(C)nc(C)[nH]c1=O
InChIInChI=1S/C10H15N3O3/c1-6-8(9(14)11-4-5-16-3)10(15)13-7(2)12-6/h4-5H2,1-3H3,(H,11,14)(H,12,13,15)
InChIKeyLFHZRASIOHBOHI-UHFFFAOYSA-N
MW225.25 g/mol
LogP-0.24
Rot. Bonds4

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

N-(2-methoxyethyl)-2,4-dimethyl-6-oxo-1H-pyrimidine-5-carboxamide (PubChem CID 136911216) has the molecular formula C10H15N3O3 and a molecular weight of 225.25 g/mol. Its IUPAC name is N-(2-methoxyethyl)-2,4-dimethyl-6-oxo-1H-pyrimidine-5-carboxamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-2,4-dimethyl-6-oxo-1H-pyrimidine-5-carboxamide
PubChem CID136911216
Molecular FormulaC10H15N3O3
Molecular Weight225.25 g/mol
Exact Mass225.11
IUPAC NameN-(2-methoxyethyl)-2,4-dimethyl-6-oxo-1H-pyrimidine-5-carboxamide
SMILESCOCCNC(=O)c1c(C)nc(C)[nH]c1=O
InChIInChI=1S/C10H15N3O3/c1-6-8(9(14)11-4-5-16-3)10(15)13-7(2)12-6/h4-5H2,1-3H3,(H,11,14)(H,12,13,15)
InChIKeyLFHZRASIOHBOHI-UHFFFAOYSA-N
XLogP-0.24
TPSA84.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 5-0.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2,4-dimethyl-6-oxo-N-(pyridin-3-ylmethyl)-1H-pyrimidine-5-carboxamide
CID 136911249
N-(2-methoxyethyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide
CID 110684796
2-tert-butyl-N-[2-(4-methoxyphenyl)ethyl]-4-methyl-6-oxo-1H-pyrimidine-5-carboxamide
CID 137016729
5-bromo-N-(2-methoxyethyl)-6-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 129393787
5-iodo-N-(2-methoxyethyl)-6-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 125491246
2,4-dimethyl-6-oxo-N-(4-propan-2-ylphenyl)-1H-pyrimidine-5-carboxamide
CID 136890119
2,6-dihydroxy-N-(2-methoxyethyl)benzamide
CID 103748859
N-(2-methoxyethyl)-4,5-dimethyl-1H-pyrazole-3-carboxamide
CID 110849199
6-chloro-N-(2-methoxyethyl)-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 126479547
N-(2-methoxyethyl)-2,4-dimethyl-6-oxopyran-3-carboxamide
CID 110699272
2,6-dimethoxy-N-(2-methoxyethyl)benzamide
CID 4128287
2-tert-butyl-4-methyl-N-[2-(4-methylphenyl)sulfanylethyl]-6-oxo-1H-pyrimidine-5-carboxamide
CID 137016802

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-2,4-dimethyl-6-oxo-1H-pyrimidine-5-carboxamide?
The IUPAC name of N-(2-methoxyethyl)-2,4-dimethyl-6-oxo-1H-pyrimidine-5-carboxamide (CID 136911216) is N-(2-methoxyethyl)-2,4-dimethyl-6-oxo-1H-pyrimidine-5-carboxamide.
What is the SMILES notation for N-(2-methoxyethyl)-2,4-dimethyl-6-oxo-1H-pyrimidine-5-carboxamide?
The canonical SMILES for N-(2-methoxyethyl)-2,4-dimethyl-6-oxo-1H-pyrimidine-5-carboxamide is COCCNC(=O)c1c(C)nc(C)[nH]c1=O.
What is the InChIKey of N-(2-methoxyethyl)-2,4-dimethyl-6-oxo-1H-pyrimidine-5-carboxamide?
The InChIKey is LFHZRASIOHBOHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O3/c1-6-8(9(14)11-4-5-16-3)10(15)13-7(2)12-6/h4-5H2,1-3H3,(H,11,14)(H,12,13,15).
What are the key properties of N-(2-methoxyethyl)-2,4-dimethyl-6-oxo-1H-pyrimidine-5-carboxamide?
N-(2-methoxyethyl)-2,4-dimethyl-6-oxo-1H-pyrimidine-5-carboxamide has a molecular weight of 225.25 g/mol, XLogP of -0.24, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-2,4-dimethyl-6-oxo-1H-pyrimidine-5-carboxamide is sourced from PubChem (CID 136911216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).