3-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]-N-[(1-thiomorpholin-4-ylcyclopentyl)methyl]propanamide

C19H26N4O3S — CID 36559246

IUPAC3-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]-N-[(1-thiomorpholin-4-ylcyclopentyl)methyl]propanamide
SMILESO=C(CCc1nc(-c2ccco2)no1)NCC1(N2CCSCC2)CCCC1
InChIInChI=1S/C19H26N4O3S/c24-16(5-6-17-21-18(22-26-17)15-4-3-11-25-15)20-14-19(7-1-2-8-19)23-9-12-27-13-10-23/h3-4,11H,1-2,5-10,12-14H2,(H,20,24)
InChIKeyMUZXXTZQWWQCNS-UHFFFAOYSA-N
MW390.51 g/mol
LogP2.74
Rot. Bonds7

About 3-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]-N-[(1-thiomorpholin-4-ylcyclopentyl)methyl]propanamide

3-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]-N-[(1-thiomorpholin-4-ylcyclopentyl)methyl]propanamide (PubChem CID 36559246) has the molecular formula C19H26N4O3S and a molecular weight of 390.51 g/mol. Its IUPAC name is 3-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]-N-[(1-thiomorpholin-4-ylcyclopentyl)methyl]propanamide.

Molecular Properties

Compound Name3-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]-N-[(1-thiomorpholin-4-ylcyclopentyl)methyl]propanamide
PubChem CID36559246
Molecular FormulaC19H26N4O3S
Molecular Weight390.51 g/mol
Exact Mass390.17
IUPAC Name3-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]-N-[(1-thiomorpholin-4-ylcyclopentyl)methyl]propanamide
SMILESO=C(CCc1nc(-c2ccco2)no1)NCC1(N2CCSCC2)CCCC1
InChIInChI=1S/C19H26N4O3S/c24-16(5-6-17-21-18(22-26-17)15-4-3-11-25-15)20-14-19(7-1-2-8-19)23-9-12-27-13-10-23/h3-4,11H,1-2,5-10,12-14H2,(H,20,24)
InChIKeyMUZXXTZQWWQCNS-UHFFFAOYSA-N
XLogP2.74
TPSA84.40 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.51
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

3-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]-N-[(1-phenylcyclopentyl)methyl]propanamide
CID 36803725
N-[[1-(4-fluorophenyl)cyclopentyl]methyl]-3-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]propanamide
CID 55745710
4-(3-tert-butyl-1,2,4-oxadiazol-5-yl)-N-[(1-thiomorpholin-4-ylcyclopentyl)methyl]butanamide
CID 36559759
3-[3-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]propanoylamino]-2,2-dimethylpropanoic acid
CID 119249678
3-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]-N-(2-methyl-2-morpholin-4-ylpropyl)propanamide
CID 134018961
3-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]-1-piperidin-1-ylpropan-1-one
CID 36656689
3-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]-N-(3-methoxypropyl)propanamide
CID 36741660
3-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]-N-(2-piperidin-1-ylphenyl)propanamide
CID 36770643
1-[4-(furan-3-carbonyl)piperazin-1-yl]-3-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]propan-1-one
CID 32535444
3-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]-N-[3-(methylcarbamoylamino)phenyl]propanamide
CID 36862559
N-(2-anilino-3-methylbutyl)-3-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]propanamide
CID 55554755
3-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]-N-[[4-(imidazol-1-ylmethyl)phenyl]methyl]propanamide
CID 37422815

Frequently Asked Questions

What is the IUPAC name of 3-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]-N-[(1-thiomorpholin-4-ylcyclopentyl)methyl]propanamide?
The IUPAC name of 3-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]-N-[(1-thiomorpholin-4-ylcyclopentyl)methyl]propanamide (CID 36559246) is 3-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]-N-[(1-thiomorpholin-4-ylcyclopentyl)methyl]propanamide.
What is the SMILES notation for 3-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]-N-[(1-thiomorpholin-4-ylcyclopentyl)methyl]propanamide?
The canonical SMILES for 3-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]-N-[(1-thiomorpholin-4-ylcyclopentyl)methyl]propanamide is O=C(CCc1nc(-c2ccco2)no1)NCC1(N2CCSCC2)CCCC1.
What is the InChIKey of 3-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]-N-[(1-thiomorpholin-4-ylcyclopentyl)methyl]propanamide?
The InChIKey is MUZXXTZQWWQCNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O3S/c24-16(5-6-17-21-18(22-26-17)15-4-3-11-25-15)20-14-19(7-1-2-8-19)23-9-12-27-13-10-23/h3-4,11H,1-2,5-10,12-14H2,(H,20,24).
What are the key properties of 3-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]-N-[(1-thiomorpholin-4-ylcyclopentyl)methyl]propanamide?
3-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]-N-[(1-thiomorpholin-4-ylcyclopentyl)methyl]propanamide has a molecular weight of 390.51 g/mol, XLogP of 2.74, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]-N-[(1-thiomorpholin-4-ylcyclopentyl)methyl]propanamide is sourced from PubChem (CID 36559246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).