N-(2-methoxyethyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide

C9H14N2O3 — CID 110684796

IUPACN-(2-methoxyethyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide
SMILESCOCCNC(=O)c1oc(C)nc1C
InChIInChI=1S/C9H14N2O3/c1-6-8(14-7(2)11-6)9(12)10-4-5-13-3/h4-5H2,1-3H3,(H,10,12)
InChIKeyBUKZXVWSIJVGRH-UHFFFAOYSA-N
MW198.22 g/mol
LogP0.67
Rot. Bonds4

About N-(2-methoxyethyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide

N-(2-methoxyethyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide (PubChem CID 110684796) has the molecular formula C9H14N2O3 and a molecular weight of 198.22 g/mol. Its IUPAC name is N-(2-methoxyethyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide
PubChem CID110684796
Molecular FormulaC9H14N2O3
Molecular Weight198.22 g/mol
Exact Mass198.10
IUPAC NameN-(2-methoxyethyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide
SMILESCOCCNC(=O)c1oc(C)nc1C
InChIInChI=1S/C9H14N2O3/c1-6-8(14-7(2)11-6)9(12)10-4-5-13-3/h4-5H2,1-3H3,(H,10,12)
InChIKeyBUKZXVWSIJVGRH-UHFFFAOYSA-N
XLogP0.67
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.22
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

methyl 3-[(2,4-dimethyl-1,3-oxazole-5-carbonyl)amino]propanoate
CID 79026371
N-[3-(2-hydroxyethoxy)propyl]-2,4-dimethyl-1,3-oxazole-5-carboxamide
CID 113365344
ethyl 3-[(2,4-dimethyl-1,3-oxazole-5-carbonyl)amino]propanoate
CID 79179747
4-[(2,4-dimethyl-1,3-oxazole-5-carbonyl)amino]butanoic acid
CID 81364652
N-(5-hydroxypentyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide
CID 107318424
N-(2-chloropropyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide
CID 114296555
N-[2-(4-hydroxyphenyl)ethyl]-2,4-dimethyl-1,3-oxazole-5-carboxamide
CID 79880788
methyl 2-[[(2,4-dimethyl-1,3-oxazole-5-carbonyl)amino]methyl]-2-ethylbutanoate
CID 166180491
2,4-dimethyl-N-(2-morpholin-4-ylethyl)-1,3-oxazole-5-carboxamide
CID 110684800
2,4-dimethyl-N-[2-[[5-(trifluoromethyl)-2-pyridinyl]oxy]ethyl]-1,3-oxazole-5-carboxamide
CID 71851017
(2S)-3-[(2,4-dimethyl-1,3-oxazole-5-carbonyl)amino]-2-hydroxypropanoic acid
CID 107833856
N-[2-(4-chlorophenyl)ethyl]-2,4-dimethyl-1,3-oxazole-5-carboxamide
CID 110684838

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide?
The IUPAC name of N-(2-methoxyethyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide (CID 110684796) is N-(2-methoxyethyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide.
What is the SMILES notation for N-(2-methoxyethyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide?
The canonical SMILES for N-(2-methoxyethyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide is COCCNC(=O)c1oc(C)nc1C.
What is the InChIKey of N-(2-methoxyethyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide?
The InChIKey is BUKZXVWSIJVGRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O3/c1-6-8(14-7(2)11-6)9(12)10-4-5-13-3/h4-5H2,1-3H3,(H,10,12).
What are the key properties of N-(2-methoxyethyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide?
N-(2-methoxyethyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide has a molecular weight of 198.22 g/mol, XLogP of 0.67, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide is sourced from PubChem (CID 110684796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).