3-ethyl-N-(furan-3-ylmethyl)-N,5-dimethyl-1,2-oxazole-4-carboxamide

C13H16N2O3 — CID 74250183

IUPAC3-ethyl-N-(furan-3-ylmethyl)-N,5-dimethyl-1,2-oxazole-4-carboxamide
SMILESCCc1noc(C)c1C(=O)N(C)Cc1ccoc1
InChIInChI=1S/C13H16N2O3/c1-4-11-12(9(2)18-14-11)13(16)15(3)7-10-5-6-17-8-10/h5-6,8H,4,7H2,1-3H3
InChIKeyRCUONUYDNLTXHA-UHFFFAOYSA-N
MW248.28 g/mol
LogP2.41
Rot. Bonds4

About 3-ethyl-N-(furan-3-ylmethyl)-N,5-dimethyl-1,2-oxazole-4-carboxamide

3-ethyl-N-(furan-3-ylmethyl)-N,5-dimethyl-1,2-oxazole-4-carboxamide (PubChem CID 74250183) has the molecular formula C13H16N2O3 and a molecular weight of 248.28 g/mol. Its IUPAC name is 3-ethyl-N-(furan-3-ylmethyl)-N,5-dimethyl-1,2-oxazole-4-carboxamide.

Molecular Properties

Compound Name3-ethyl-N-(furan-3-ylmethyl)-N,5-dimethyl-1,2-oxazole-4-carboxamide
PubChem CID74250183
Molecular FormulaC13H16N2O3
Molecular Weight248.28 g/mol
Exact Mass248.12
IUPAC Name3-ethyl-N-(furan-3-ylmethyl)-N,5-dimethyl-1,2-oxazole-4-carboxamide
SMILESCCc1noc(C)c1C(=O)N(C)Cc1ccoc1
InChIInChI=1S/C13H16N2O3/c1-4-11-12(9(2)18-14-11)13(16)15(3)7-10-5-6-17-8-10/h5-6,8H,4,7H2,1-3H3
InChIKeyRCUONUYDNLTXHA-UHFFFAOYSA-N
XLogP2.41
TPSA59.48 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.28
LogP ≤ 52.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-ethyl-N,5-dimethyl-1,2-oxazole-4-carboxamide
CID 31363980
N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-3-ethyl-N,5-dimethyl-1,2-oxazole-4-carboxamide
CID 9206070
N-(furan-3-ylmethyl)-N,4-dimethylbenzamide
CID 110868919
N,N,3-triethyl-5-methyl-1,2-oxazole-4-carboxamide
CID 51073384
methyl 3-[(3-ethyl-5-methyl-1,2-oxazole-4-carbonyl)-methylamino]propanoate
CID 54997668
2-chloro-N-(furan-3-ylmethyl)-N-methylfuran-3-carboxamide
CID 106686601
3-amino-N-(furan-3-ylmethyl)-N,2-dimethylbenzamide
CID 61421960
5-chloro-N-(furan-3-ylmethyl)-N-methylpyrazine-2-carboxamide
CID 107252485
N-(furan-3-ylmethyl)-N-methyl-1H-pyrazole-4-carboxamide
CID 61151195
N-(furan-3-ylmethyl)-3-hydroxy-N-methylpyridine-2-carboxamide
CID 61422868
2-amino-N-(furan-3-ylmethyl)-N,4-dimethyl-1,3-thiazole-5-carboxamide
CID 62793462
3-ethyl-5-methyl-1,2-oxazole-4-carboxylic acid
CID 2063310

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-(furan-3-ylmethyl)-N,5-dimethyl-1,2-oxazole-4-carboxamide?
The IUPAC name of 3-ethyl-N-(furan-3-ylmethyl)-N,5-dimethyl-1,2-oxazole-4-carboxamide (CID 74250183) is 3-ethyl-N-(furan-3-ylmethyl)-N,5-dimethyl-1,2-oxazole-4-carboxamide.
What is the SMILES notation for 3-ethyl-N-(furan-3-ylmethyl)-N,5-dimethyl-1,2-oxazole-4-carboxamide?
The canonical SMILES for 3-ethyl-N-(furan-3-ylmethyl)-N,5-dimethyl-1,2-oxazole-4-carboxamide is CCc1noc(C)c1C(=O)N(C)Cc1ccoc1.
What is the InChIKey of 3-ethyl-N-(furan-3-ylmethyl)-N,5-dimethyl-1,2-oxazole-4-carboxamide?
The InChIKey is RCUONUYDNLTXHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O3/c1-4-11-12(9(2)18-14-11)13(16)15(3)7-10-5-6-17-8-10/h5-6,8H,4,7H2,1-3H3.
What are the key properties of 3-ethyl-N-(furan-3-ylmethyl)-N,5-dimethyl-1,2-oxazole-4-carboxamide?
3-ethyl-N-(furan-3-ylmethyl)-N,5-dimethyl-1,2-oxazole-4-carboxamide has a molecular weight of 248.28 g/mol, XLogP of 2.41, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-(furan-3-ylmethyl)-N,5-dimethyl-1,2-oxazole-4-carboxamide is sourced from PubChem (CID 74250183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).