(2,5-dimethyl-1,3-oxazol-4-yl)-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)methanone

C11H13FN2O2 — CID 126767164

IUPAC(2,5-dimethyl-1,3-oxazol-4-yl)-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)methanone
SMILESCc1nc(C(=O)N2CCC=C(F)C2)c(C)o1
InChIInChI=1S/C11H13FN2O2/c1-7-10(13-8(2)16-7)11(15)14-5-3-4-9(12)6-14/h4H,3,5-6H2,1-2H3
InChIKeyORTKHOHGTRZBJK-UHFFFAOYSA-N
MW224.23 g/mol
LogP1.99
Rot. Bonds1

About (2,5-dimethyl-1,3-oxazol-4-yl)-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)methanone

(2,5-dimethyl-1,3-oxazol-4-yl)-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)methanone (PubChem CID 126767164) has the molecular formula C11H13FN2O2 and a molecular weight of 224.23 g/mol. Its IUPAC name is (2,5-dimethyl-1,3-oxazol-4-yl)-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)methanone.

Molecular Properties

Compound Name(2,5-dimethyl-1,3-oxazol-4-yl)-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)methanone
PubChem CID126767164
Molecular FormulaC11H13FN2O2
Molecular Weight224.23 g/mol
Exact Mass224.10
IUPAC Name(2,5-dimethyl-1,3-oxazol-4-yl)-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)methanone
SMILESCc1nc(C(=O)N2CCC=C(F)C2)c(C)o1
InChIInChI=1S/C11H13FN2O2/c1-7-10(13-8(2)16-7)11(15)14-5-3-4-9(12)6-14/h4H,3,5-6H2,1-2H3
InChIKeyORTKHOHGTRZBJK-UHFFFAOYSA-N
XLogP1.99
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.23
LogP ≤ 51.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-2,5-dimethyl-N-(2-methylallyl)-1,3-oxazole-4-carboxamide
CID 53195125
"2,5-dimethyl-N-(2-morpholinoethyl)-1,3-oxazole-4-carboxamide"
CID 53195158
(2,5-Dimethyl-1,3-oxazol-4-yl)(1,4-thiazinan-4-yl)methanone
CID 53195166
N-butyl-N,2,5-trimethyl-1,3-oxazole-4-carboxamide
CID 53195169
1-(2,5-Dimethyl-1,3-oxazole-4-carbonyl)azepane
CID 53195173
1-Cyclohexyl-4-(2,5-dimethyl-1,3-oxazole-4-carbonyl)piperazine
CID 53195174
1-(2,5-Dimethyl-1,3-oxazole-4-carbonyl)-4-(prop-2-EN-1-YL)piperazine
CID 53195176
N,2,5-trimethyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)-1,3-oxazole-4-carboxamide
CID 53195179
2,5-dimethyl-N-[2-(4-methylpiperazin-1-yl)ethyl]-1,3-oxazole-4-carboxamide
CID 53195189
(2-Isopropyl-5-methyl-1,3-oxazol-4-yl)(morpholino)methanone
CID 53195248
2-{[(2,2-dimethylpropanoyl)amino]methyl}-N~4~,N~4~-diethyl-5-methyl-1,3-oxazole-4-carboxamide
CID 53195614
tert-butyl N-[3-[(2,5-dimethyl-1,3-oxazole-4-carbonyl)-methylamino]propyl]-N-methylcarbamate
CID 126818833

Frequently Asked Questions

What is the IUPAC name of (2,5-dimethyl-1,3-oxazol-4-yl)-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)methanone?
The IUPAC name of (2,5-dimethyl-1,3-oxazol-4-yl)-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)methanone (CID 126767164) is (2,5-dimethyl-1,3-oxazol-4-yl)-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)methanone.
What is the SMILES notation for (2,5-dimethyl-1,3-oxazol-4-yl)-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)methanone?
The canonical SMILES for (2,5-dimethyl-1,3-oxazol-4-yl)-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)methanone is Cc1nc(C(=O)N2CCC=C(F)C2)c(C)o1.
What is the InChIKey of (2,5-dimethyl-1,3-oxazol-4-yl)-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)methanone?
The InChIKey is ORTKHOHGTRZBJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FN2O2/c1-7-10(13-8(2)16-7)11(15)14-5-3-4-9(12)6-14/h4H,3,5-6H2,1-2H3.
What are the key properties of (2,5-dimethyl-1,3-oxazol-4-yl)-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)methanone?
(2,5-dimethyl-1,3-oxazol-4-yl)-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)methanone has a molecular weight of 224.23 g/mol, XLogP of 1.99, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-dimethyl-1,3-oxazol-4-yl)-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)methanone is sourced from PubChem (CID 126767164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).