(3-ethyl-5-methyl-1,2-oxazol-4-yl)-pyrrolidin-1-ylmethanone

C11H16N2O2 — CID 1245980

IUPAC(3-ethyl-5-methyl-1,2-oxazol-4-yl)-pyrrolidin-1-ylmethanone
SMILESCCc1noc(C)c1C(=O)N1CCCC1
InChIInChI=1S/C11H16N2O2/c1-3-9-10(8(2)15-12-9)11(14)13-6-4-5-7-13/h3-7H2,1-2H3
InChIKeyFMYROTSIDIUQEQ-UHFFFAOYSA-N
MW208.26 g/mol
LogP1.78
Rot. Bonds2

About (3-ethyl-5-methyl-1,2-oxazol-4-yl)-pyrrolidin-1-ylmethanone

(3-ethyl-5-methyl-1,2-oxazol-4-yl)-pyrrolidin-1-ylmethanone (PubChem CID 1245980) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is (3-ethyl-5-methyl-1,2-oxazol-4-yl)-pyrrolidin-1-ylmethanone.

Molecular Properties

Compound Name(3-ethyl-5-methyl-1,2-oxazol-4-yl)-pyrrolidin-1-ylmethanone
PubChem CID1245980
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name(3-ethyl-5-methyl-1,2-oxazol-4-yl)-pyrrolidin-1-ylmethanone
SMILESCCc1noc(C)c1C(=O)N1CCCC1
InChIInChI=1S/C11H16N2O2/c1-3-9-10(8(2)15-12-9)11(14)13-6-4-5-7-13/h3-7H2,1-2H3
InChIKeyFMYROTSIDIUQEQ-UHFFFAOYSA-N
XLogP1.78
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 51.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(cyclohex-1-en-1-yl)ethyl]-3,5-dimethyl-1,2-oxazole-4-carboxamide
CID 1245261
(3-Ethyl-5-methylisoxazol-4-yl)(morpholino)methanone
CID 1245299
(3,5-Dimethyl-1,2-oxazol-4-yl)-[2-(2-methylpropyl)-2,9-diazaspiro[5.5]undecan-9-yl]methanone
CID 3234303
(2,6-Dimethylmorpholin-4-yl)(3-ethyl-5-methyl-1,2-oxazol-4-yl)methanone
CID 3245328
N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-butyl-3-ethyl-5-methyl-1,2-oxazole-4-carboxamide
CID 24982741
N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N,3-diethyl-5-methyl-1,2-oxazole-4-carboxamide
CID 24982677
N-[6-amino-1-(2-methylpropyl)-2,4-dioxopyrimidin-5-yl]-N-butyl-3-ethyl-5-methyl-1,2-oxazole-4-carboxamide
CID 25163169
1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)-3-methyl-N-propylpiperidine-3-carboxamide
CID 46942636
3,5-dimethyl-N-[3-(2-oxo-1-pyrrolidinyl)propyl]-4-isoxazolecarboxamide
CID 2225560
3,5,7-Trimethyl-[1,2]oxazolo[4,5-d]pyridazin-4-one
CID 2745399
N-(2-(Dimethylamino)ethyl)-3-ethyl-5-methylisoxazole-4-carboxamide
CID 1245014
(3,5-Dimethyl-4-isoxazolyl)(1-pyrrolidinyl)methanone
CID 2798231

Frequently Asked Questions

What is the IUPAC name of (3-ethyl-5-methyl-1,2-oxazol-4-yl)-pyrrolidin-1-ylmethanone?
The IUPAC name of (3-ethyl-5-methyl-1,2-oxazol-4-yl)-pyrrolidin-1-ylmethanone (CID 1245980) is (3-ethyl-5-methyl-1,2-oxazol-4-yl)-pyrrolidin-1-ylmethanone.
What is the SMILES notation for (3-ethyl-5-methyl-1,2-oxazol-4-yl)-pyrrolidin-1-ylmethanone?
The canonical SMILES for (3-ethyl-5-methyl-1,2-oxazol-4-yl)-pyrrolidin-1-ylmethanone is CCc1noc(C)c1C(=O)N1CCCC1.
What is the InChIKey of (3-ethyl-5-methyl-1,2-oxazol-4-yl)-pyrrolidin-1-ylmethanone?
The InChIKey is FMYROTSIDIUQEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-3-9-10(8(2)15-12-9)11(14)13-6-4-5-7-13/h3-7H2,1-2H3.
What are the key properties of (3-ethyl-5-methyl-1,2-oxazol-4-yl)-pyrrolidin-1-ylmethanone?
(3-ethyl-5-methyl-1,2-oxazol-4-yl)-pyrrolidin-1-ylmethanone has a molecular weight of 208.26 g/mol, XLogP of 1.78, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethyl-5-methyl-1,2-oxazol-4-yl)-pyrrolidin-1-ylmethanone is sourced from PubChem (CID 1245980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).