5-[(6-methyl-3-pyridinyl)oxymethyl]-N-[2-(3-methylthiophen-2-yl)ethyl]-1,2-oxazole-3-carboxamide

C18H19N3O3S — CID 56708025

IUPAC5-[(6-methyl-3-pyridinyl)oxymethyl]-N-[2-(3-methylthiophen-2-yl)ethyl]-1,2-oxazole-3-carboxamide
SMILESCc1ccc(OCc2cc(C(=O)NCCc3sccc3C)no2)cn1
InChIInChI=1S/C18H19N3O3S/c1-12-6-8-25-17(12)5-7-19-18(22)16-9-15(24-21-16)11-23-14-4-3-13(2)20-10-14/h3-4,6,8-10H,5,7,11H2,1-2H3,(H,19,22)
InChIKeyMMSMXAGMPMOLHP-UHFFFAOYSA-N
MW357.44 g/mol
LogP3.30
Rot. Bonds7

About 5-[(6-methyl-3-pyridinyl)oxymethyl]-N-[2-(3-methylthiophen-2-yl)ethyl]-1,2-oxazole-3-carboxamide

5-[(6-methyl-3-pyridinyl)oxymethyl]-N-[2-(3-methylthiophen-2-yl)ethyl]-1,2-oxazole-3-carboxamide (PubChem CID 56708025) has the molecular formula C18H19N3O3S and a molecular weight of 357.44 g/mol. Its IUPAC name is 5-[(6-methyl-3-pyridinyl)oxymethyl]-N-[2-(3-methylthiophen-2-yl)ethyl]-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name5-[(6-methyl-3-pyridinyl)oxymethyl]-N-[2-(3-methylthiophen-2-yl)ethyl]-1,2-oxazole-3-carboxamide
PubChem CID56708025
Molecular FormulaC18H19N3O3S
Molecular Weight357.44 g/mol
Exact Mass357.11
IUPAC Name5-[(6-methyl-3-pyridinyl)oxymethyl]-N-[2-(3-methylthiophen-2-yl)ethyl]-1,2-oxazole-3-carboxamide
SMILESCc1ccc(OCc2cc(C(=O)NCCc3sccc3C)no2)cn1
InChIInChI=1S/C18H19N3O3S/c1-12-6-8-25-17(12)5-7-19-18(22)16-9-15(24-21-16)11-23-14-4-3-13(2)20-10-14/h3-4,6,8-10H,5,7,11H2,1-2H3,(H,19,22)
InChIKeyMMSMXAGMPMOLHP-UHFFFAOYSA-N
XLogP3.30
TPSA77.25 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.44
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 5-[(6-methyl-3-pyridinyl)oxymethyl]-N-[2-(3-methylthiophen-2-yl)ethyl]-1,2-oxazole-3-carboxamide with MolForge

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Related Compounds

5-[(6-methyl-3-pyridinyl)oxymethyl]-N-(quinolin-4-ylmethyl)-1,2-oxazole-3-carboxamide
CID 42094150
N-[(1,3-dimethyl-2-oxobenzimidazol-5-yl)methyl]-5-[(6-methyl-3-pyridinyl)oxymethyl]-1,2-oxazole-3-carboxamide
CID 29182088
5-methyl-N-[(3-methylthiophen-2-yl)methyl]-1,2-oxazole-3-carboxamide
CID 47163642
N-(3-hydroxy-3-prop-2-enylhex-5-en-2-yl)-5-[(6-methyl-3-pyridinyl)oxymethyl]-1,2-oxazole-3-carboxamide
CID 45201600
N-methyl-1-[5-[(6-methyl-3-pyridinyl)oxymethyl]-1,2-oxazol-3-yl]methanamine
CID 62442813
5-[(2,6-difluorophenoxy)methyl]-N-methyl-N-[(3-methylthiophen-2-yl)methyl]-1,2-oxazole-3-carboxamide
CID 56759947
2-methyl-N-[[5-[(6-methyl-3-pyridinyl)oxymethyl]-1,2-oxazol-3-yl]methyl]propan-2-amine
CID 62443200
N-[(5-methylpyrazin-2-yl)methyl]-5-(quinolin-6-yloxymethyl)-1,2-oxazole-3-carboxamide
CID 74229782
N-[2-(5-methyl-1H-imidazol-2-yl)ethyl]-5-(5,6,7,8-tetrahydronaphthalen-2-yloxymethyl)-1,2-oxazole-3-carboxamide
CID 42098395
N-propyl-5-[[4-(thiophene-2-carbonylamino)phenoxy]methyl]-1,2-oxazole-3-carboxamide
CID 53110194
methyl 2-[2-(3-methylthiophen-2-yl)ethylamino]-2-oxoacetate
CID 115142589
methyl N-[2-(3-methylthiophen-2-yl)ethyl]carbamate
CID 115190738

Frequently Asked Questions

What is the IUPAC name of 5-[(6-methyl-3-pyridinyl)oxymethyl]-N-[2-(3-methylthiophen-2-yl)ethyl]-1,2-oxazole-3-carboxamide?
The IUPAC name of 5-[(6-methyl-3-pyridinyl)oxymethyl]-N-[2-(3-methylthiophen-2-yl)ethyl]-1,2-oxazole-3-carboxamide (CID 56708025) is 5-[(6-methyl-3-pyridinyl)oxymethyl]-N-[2-(3-methylthiophen-2-yl)ethyl]-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 5-[(6-methyl-3-pyridinyl)oxymethyl]-N-[2-(3-methylthiophen-2-yl)ethyl]-1,2-oxazole-3-carboxamide?
The canonical SMILES for 5-[(6-methyl-3-pyridinyl)oxymethyl]-N-[2-(3-methylthiophen-2-yl)ethyl]-1,2-oxazole-3-carboxamide is Cc1ccc(OCc2cc(C(=O)NCCc3sccc3C)no2)cn1.
What is the InChIKey of 5-[(6-methyl-3-pyridinyl)oxymethyl]-N-[2-(3-methylthiophen-2-yl)ethyl]-1,2-oxazole-3-carboxamide?
The InChIKey is MMSMXAGMPMOLHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O3S/c1-12-6-8-25-17(12)5-7-19-18(22)16-9-15(24-21-16)11-23-14-4-3-13(2)20-10-14/h3-4,6,8-10H,5,7,11H2,1-2H3,(H,19,22).
What are the key properties of 5-[(6-methyl-3-pyridinyl)oxymethyl]-N-[2-(3-methylthiophen-2-yl)ethyl]-1,2-oxazole-3-carboxamide?
5-[(6-methyl-3-pyridinyl)oxymethyl]-N-[2-(3-methylthiophen-2-yl)ethyl]-1,2-oxazole-3-carboxamide has a molecular weight of 357.44 g/mol, XLogP of 3.30, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(6-methyl-3-pyridinyl)oxymethyl]-N-[2-(3-methylthiophen-2-yl)ethyl]-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 56708025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).