N-(2,5-dimethyl-1,2,4-triazol-3-yl)-2-ethyl-4-methyl-1,3-oxazole-5-carboxamide

C11H15N5O2 — CID 136545208

IUPACN-(2,5-dimethyl-1,2,4-triazol-3-yl)-2-ethyl-4-methyl-1,3-oxazole-5-carboxamide
SMILESCCc1nc(C)c(C(=O)Nc2nc(C)nn2C)o1
InChIInChI=1S/C11H15N5O2/c1-5-8-12-6(2)9(18-8)10(17)14-11-13-7(3)15-16(11)4/h5H2,1-4H3,(H,13,14,15,17)
InChIKeyCYXURKMDKWFYIS-UHFFFAOYSA-N
MW249.27 g/mol
LogP1.23
Rot. Bonds3

About N-(2,5-dimethyl-1,2,4-triazol-3-yl)-2-ethyl-4-methyl-1,3-oxazole-5-carboxamide

N-(2,5-dimethyl-1,2,4-triazol-3-yl)-2-ethyl-4-methyl-1,3-oxazole-5-carboxamide (PubChem CID 136545208) has the molecular formula C11H15N5O2 and a molecular weight of 249.27 g/mol. Its IUPAC name is N-(2,5-dimethyl-1,2,4-triazol-3-yl)-2-ethyl-4-methyl-1,3-oxazole-5-carboxamide.

Molecular Properties

Compound NameN-(2,5-dimethyl-1,2,4-triazol-3-yl)-2-ethyl-4-methyl-1,3-oxazole-5-carboxamide
PubChem CID136545208
Molecular FormulaC11H15N5O2
Molecular Weight249.27 g/mol
Exact Mass249.12
IUPAC NameN-(2,5-dimethyl-1,2,4-triazol-3-yl)-2-ethyl-4-methyl-1,3-oxazole-5-carboxamide
SMILESCCc1nc(C)c(C(=O)Nc2nc(C)nn2C)o1
InChIInChI=1S/C11H15N5O2/c1-5-8-12-6(2)9(18-8)10(17)14-11-13-7(3)15-16(11)4/h5H2,1-4H3,(H,13,14,15,17)
InChIKeyCYXURKMDKWFYIS-UHFFFAOYSA-N
XLogP1.23
TPSA85.84 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.27
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Launch Full Analysis

Related Compounds

N-[2-chloro-5-(diethylcarbamoyl)phenyl]-2-ethyl-4-methyl-1,3-oxazole-5-carboxamide
CID 50971382
2-ethyl-4-methyl-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1,3-oxazole-5-carboxamide
CID 86700839
2-ethyl-4-methyl-N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]-1,3-oxazole-5-carboxamide
CID 131917366
N-(2,5-dimethyl-1,2,4-triazol-3-yl)-2,2-difluoroacetamide
CID 130710336
N-(2,5-dimethyl-1,2,4-triazol-3-yl)-5-methylpyrazine-2-carboxamide
CID 131960922
2-ethyl-N-[(8S)-2-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl]-4-methyl-1,3-oxazole-5-carboxamide
CID 125144382
N-(2,5-dimethyl-1,2,4-triazol-3-yl)-3-phenyl-1,2-oxazole-5-carboxamide
CID 86789667
N-(2,5-dimethyl-1,2,4-triazol-3-yl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)butanamide
CID 154738324
ethyl 1-[(2-ethyl-4-methyl-1,3-oxazole-5-carbonyl)amino]cyclobutane-1-carboxylate
CID 50971554
2-ethyl-4-methyl-N-[(1S)-1-(5-methyl-1H-1,2,4-triazol-3-yl)ethyl]-1,3-oxazole-5-carboxamide
CID 95199242
2-ethyl-4-methyl-N-[[1-[2-(tetrazol-1-yl)acetyl]piperidin-4-yl]methyl]-1,3-oxazole-5-carboxamide
CID 131944892
(2-ethyl-4-methyl-1,3-oxazol-5-yl)-[4-(2-methylpyrazol-3-yl)piperidin-1-yl]methanone
CID 128516662

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethyl-1,2,4-triazol-3-yl)-2-ethyl-4-methyl-1,3-oxazole-5-carboxamide?
The IUPAC name of N-(2,5-dimethyl-1,2,4-triazol-3-yl)-2-ethyl-4-methyl-1,3-oxazole-5-carboxamide (CID 136545208) is N-(2,5-dimethyl-1,2,4-triazol-3-yl)-2-ethyl-4-methyl-1,3-oxazole-5-carboxamide.
What is the SMILES notation for N-(2,5-dimethyl-1,2,4-triazol-3-yl)-2-ethyl-4-methyl-1,3-oxazole-5-carboxamide?
The canonical SMILES for N-(2,5-dimethyl-1,2,4-triazol-3-yl)-2-ethyl-4-methyl-1,3-oxazole-5-carboxamide is CCc1nc(C)c(C(=O)Nc2nc(C)nn2C)o1.
What is the InChIKey of N-(2,5-dimethyl-1,2,4-triazol-3-yl)-2-ethyl-4-methyl-1,3-oxazole-5-carboxamide?
The InChIKey is CYXURKMDKWFYIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O2/c1-5-8-12-6(2)9(18-8)10(17)14-11-13-7(3)15-16(11)4/h5H2,1-4H3,(H,13,14,15,17).
What are the key properties of N-(2,5-dimethyl-1,2,4-triazol-3-yl)-2-ethyl-4-methyl-1,3-oxazole-5-carboxamide?
N-(2,5-dimethyl-1,2,4-triazol-3-yl)-2-ethyl-4-methyl-1,3-oxazole-5-carboxamide has a molecular weight of 249.27 g/mol, XLogP of 1.23, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethyl-1,2,4-triazol-3-yl)-2-ethyl-4-methyl-1,3-oxazole-5-carboxamide is sourced from PubChem (CID 136545208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).