N-ethyl-5-methyl-N-(2-methylpropyl)-1,2-oxazole-3-carboxamide

C11H18N2O2 — CID 51077472

IUPACN-ethyl-5-methyl-N-(2-methylpropyl)-1,2-oxazole-3-carboxamide
SMILESCCN(CC(C)C)C(=O)c1cc(C)on1
InChIInChI=1S/C11H18N2O2/c1-5-13(7-8(2)3)11(14)10-6-9(4)15-12-10/h6,8H,5,7H2,1-4H3
InChIKeyJIYQARMDAVPPHZ-UHFFFAOYSA-N
MW210.28 g/mol
LogP2.10
Rot. Bonds4

About N-ethyl-5-methyl-N-(2-methylpropyl)-1,2-oxazole-3-carboxamide

N-ethyl-5-methyl-N-(2-methylpropyl)-1,2-oxazole-3-carboxamide (PubChem CID 51077472) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is N-ethyl-5-methyl-N-(2-methylpropyl)-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-ethyl-5-methyl-N-(2-methylpropyl)-1,2-oxazole-3-carboxamide
PubChem CID51077472
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC NameN-ethyl-5-methyl-N-(2-methylpropyl)-1,2-oxazole-3-carboxamide
SMILESCCN(CC(C)C)C(=O)c1cc(C)on1
InChIInChI=1S/C11H18N2O2/c1-5-13(7-8(2)3)11(14)10-6-9(4)15-12-10/h6,8H,5,7H2,1-4H3
InChIKeyJIYQARMDAVPPHZ-UHFFFAOYSA-N
XLogP2.10
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 52.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

Cym-5541
CID 17253208
N-cyclohexyl-N,5-dimethyl-3-isoxazolecarboxamide
CID 2814457
N-cyclohexyl-5-propyl-3-isoxazolecarboxamide
CID 5307570
N,N-dicyclohexyl-5-propyl-3-isoxazolecarboxamide
CID 5309153
N-cyclohexyl-5-cyclopropylisoxazole-3-carboxamide
CID 16188020
methyl N-(5-methyl-1,2-oxazole-3-carbonyl)glycinate
CID 2747412
5-methyl-N-[3-(2-oxo-1-pyrrolidinyl)propyl]-3-isoxazolecarboxamide
CID 2225426
N,N-dicyclohexyl-5-methylisoxazole-3-carboxamide
CID 3245758
N-(Butan-2-YL)-5-(2-methylpropyl)-1,2-oxazole-3-carboxamide
CID 5307751
3-Methyl-N-propylisoxazole-5-carboxamide
CID 9551512
N,N-dicyclohexyl-5-isopropyl-3-isoxazolecarboxamide
CID 17253281
N,N-dicyclohexyl-5-(2-methylpropyl)-1,2-oxazole-3-carboxamide
CID 25110485

Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-methyl-N-(2-methylpropyl)-1,2-oxazole-3-carboxamide?
The IUPAC name of N-ethyl-5-methyl-N-(2-methylpropyl)-1,2-oxazole-3-carboxamide (CID 51077472) is N-ethyl-5-methyl-N-(2-methylpropyl)-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-ethyl-5-methyl-N-(2-methylpropyl)-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-ethyl-5-methyl-N-(2-methylpropyl)-1,2-oxazole-3-carboxamide is CCN(CC(C)C)C(=O)c1cc(C)on1.
What is the InChIKey of N-ethyl-5-methyl-N-(2-methylpropyl)-1,2-oxazole-3-carboxamide?
The InChIKey is JIYQARMDAVPPHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-5-13(7-8(2)3)11(14)10-6-9(4)15-12-10/h6,8H,5,7H2,1-4H3.
What are the key properties of N-ethyl-5-methyl-N-(2-methylpropyl)-1,2-oxazole-3-carboxamide?
N-ethyl-5-methyl-N-(2-methylpropyl)-1,2-oxazole-3-carboxamide has a molecular weight of 210.28 g/mol, XLogP of 2.10, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-methyl-N-(2-methylpropyl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 51077472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).