4-ethyl-2-methyl-N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-1,3-thiazole-5-carboxamide

C13H18N4O2S — CID 118774250

IUPAC4-ethyl-2-methyl-N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-1,3-thiazole-5-carboxamide
SMILESCCc1nc(C)sc1C(=O)NC(CC)c1nc(C)no1
InChIInChI=1S/C13H18N4O2S/c1-5-9-11(20-8(4)15-9)12(18)16-10(6-2)13-14-7(3)17-19-13/h10H,5-6H2,1-4H3,(H,16,18)
InChIKeySRUPDZURXZPRBR-UHFFFAOYSA-N
MW294.38 g/mol
LogP2.59
Rot. Bonds5

About 4-ethyl-2-methyl-N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-1,3-thiazole-5-carboxamide

4-ethyl-2-methyl-N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-1,3-thiazole-5-carboxamide (PubChem CID 118774250) has the molecular formula C13H18N4O2S and a molecular weight of 294.38 g/mol. Its IUPAC name is 4-ethyl-2-methyl-N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name4-ethyl-2-methyl-N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-1,3-thiazole-5-carboxamide
PubChem CID118774250
Molecular FormulaC13H18N4O2S
Molecular Weight294.38 g/mol
Exact Mass294.12
IUPAC Name4-ethyl-2-methyl-N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-1,3-thiazole-5-carboxamide
SMILESCCc1nc(C)sc1C(=O)NC(CC)c1nc(C)no1
InChIInChI=1S/C13H18N4O2S/c1-5-9-11(20-8(4)15-9)12(18)16-10(6-2)13-14-7(3)17-19-13/h10H,5-6H2,1-4H3,(H,16,18)
InChIKeySRUPDZURXZPRBR-UHFFFAOYSA-N
XLogP2.59
TPSA80.91 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.38
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-chloro-1,5-dimethyl-N-[(1R)-1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]pyrazole-3-carboxamide
CID 125165236
N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-2-oxo-1,3-dihydroimidazole-4-carboxamide
CID 91769195
N-(1-cyanobutyl)-4-ethyl-2-methyl-1,3-thiazole-5-carboxamide
CID 139725811
5-methoxy-1-methyl-N-[(1S)-1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]indole-2-carboxamide
CID 97112460
3-(4,5-dimethyl-1,3-thiazol-2-yl)-N-[(1R)-1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]benzamide
CID 125171592
4-[2-hydroxyethyl(methyl)amino]-N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]benzamide
CID 91760035
4-ethyl-2-methyl-N-[(1S)-2,2,2-trifluoro-1-pyridin-3-ylethyl]-1,3-thiazole-5-carboxamide
CID 99946797
N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-3-(5-methyltetrazol-1-yl)propanamide
CID 91792687
N-[cyano(propoxy)methyl]-4-ethyl-2-methyl-1,3-thiazole-5-carboxamide
CID 14796165
N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-2-(2-methylprop-2-enoxy)benzamide
CID 46993244
3-ethyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)-(oxan-4-yl)methyl]thiophene-2-carboxamide
CID 128966227
4-methyl-N-[2-methyl-1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-2-propyl-1,3-thiazole-5-carboxamide
CID 86938357

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2-methyl-N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-1,3-thiazole-5-carboxamide?
The IUPAC name of 4-ethyl-2-methyl-N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-1,3-thiazole-5-carboxamide (CID 118774250) is 4-ethyl-2-methyl-N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 4-ethyl-2-methyl-N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-1,3-thiazole-5-carboxamide?
The canonical SMILES for 4-ethyl-2-methyl-N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-1,3-thiazole-5-carboxamide is CCc1nc(C)sc1C(=O)NC(CC)c1nc(C)no1.
What is the InChIKey of 4-ethyl-2-methyl-N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-1,3-thiazole-5-carboxamide?
The InChIKey is SRUPDZURXZPRBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O2S/c1-5-9-11(20-8(4)15-9)12(18)16-10(6-2)13-14-7(3)17-19-13/h10H,5-6H2,1-4H3,(H,16,18).
What are the key properties of 4-ethyl-2-methyl-N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-1,3-thiazole-5-carboxamide?
4-ethyl-2-methyl-N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-1,3-thiazole-5-carboxamide has a molecular weight of 294.38 g/mol, XLogP of 2.59, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2-methyl-N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 118774250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).