3-[3-(furan-3-yl)-1,2,4-oxadiazol-5-yl]-N-(2-piperidin-3-ylethyl)propanamide

C16H22N4O3 — CID 119555415

IUPAC3-[3-(furan-3-yl)-1,2,4-oxadiazol-5-yl]-N-(2-piperidin-3-ylethyl)propanamide
SMILESO=C(CCc1nc(-c2ccoc2)no1)NCCC1CCCNC1
InChIInChI=1S/C16H22N4O3/c21-14(18-8-5-12-2-1-7-17-10-12)3-4-15-19-16(20-23-15)13-6-9-22-11-13/h6,9,11-12,17H,1-5,7-8,10H2,(H,18,21)
InChIKeyLCECRQMKGRPQRB-UHFFFAOYSA-N
MW318.38 g/mol
LogP1.77
Rot. Bonds7

About 3-[3-(furan-3-yl)-1,2,4-oxadiazol-5-yl]-N-(2-piperidin-3-ylethyl)propanamide

3-[3-(furan-3-yl)-1,2,4-oxadiazol-5-yl]-N-(2-piperidin-3-ylethyl)propanamide (PubChem CID 119555415) has the molecular formula C16H22N4O3 and a molecular weight of 318.38 g/mol. Its IUPAC name is 3-[3-(furan-3-yl)-1,2,4-oxadiazol-5-yl]-N-(2-piperidin-3-ylethyl)propanamide.

Molecular Properties

Compound Name3-[3-(furan-3-yl)-1,2,4-oxadiazol-5-yl]-N-(2-piperidin-3-ylethyl)propanamide
PubChem CID119555415
Molecular FormulaC16H22N4O3
Molecular Weight318.38 g/mol
Exact Mass318.17
IUPAC Name3-[3-(furan-3-yl)-1,2,4-oxadiazol-5-yl]-N-(2-piperidin-3-ylethyl)propanamide
SMILESO=C(CCc1nc(-c2ccoc2)no1)NCCC1CCCNC1
InChIInChI=1S/C16H22N4O3/c21-14(18-8-5-12-2-1-7-17-10-12)3-4-15-19-16(20-23-15)13-6-9-22-11-13/h6,9,11-12,17H,1-5,7-8,10H2,(H,18,21)
InChIKeyLCECRQMKGRPQRB-UHFFFAOYSA-N
XLogP1.77
TPSA93.19 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.38
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[2-(3,5-dimethylpiperidin-1-yl)ethyl]-3-[3-(furan-3-yl)-1,2,4-oxadiazol-5-yl]propanamide
CID 102602935
3-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)-N-(2-pyrrolidin-3-ylethyl)propanamide
CID 119535454
3-(5-phenyl-1,3-oxazol-2-yl)-N-(2-piperidin-3-ylethyl)propanamide;dihydrochloride
CID 119556270
N-[(2R)-2-(ethylamino)propyl]-3-[3-(furan-3-yl)-1,2,4-oxadiazol-5-yl]propanamide;hydrochloride
CID 120652436
3-(4-fluorophenyl)-N-[2-[(3S)-piperidin-3-yl]ethyl]propanamide
CID 99776078
N-piperidin-3-yl-3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propanamide
CID 119425726
N-piperidin-3-yl-3-[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]propanamide
CID 119425634
3-[5-(2,2-dimethylpropyl)-1,2,4-oxadiazol-3-yl]-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride
CID 119557781
2-[3-[3-(furan-3-yl)-1,2,4-oxadiazol-5-yl]propanoylamino]propanoic acid
CID 119225155
3-[3-(4-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-piperidin-3-ylpropanamide
CID 119425088
2-(furan-3-yl)-N-(piperidin-3-ylmethyl)-1,3-thiazole-4-carboxamide
CID 119464645
N-(2-piperidin-3-ylethyl)-3-thiophen-3-ylpropanamide;hydrochloride
CID 119555094

Frequently Asked Questions

What is the IUPAC name of 3-[3-(furan-3-yl)-1,2,4-oxadiazol-5-yl]-N-(2-piperidin-3-ylethyl)propanamide?
The IUPAC name of 3-[3-(furan-3-yl)-1,2,4-oxadiazol-5-yl]-N-(2-piperidin-3-ylethyl)propanamide (CID 119555415) is 3-[3-(furan-3-yl)-1,2,4-oxadiazol-5-yl]-N-(2-piperidin-3-ylethyl)propanamide.
What is the SMILES notation for 3-[3-(furan-3-yl)-1,2,4-oxadiazol-5-yl]-N-(2-piperidin-3-ylethyl)propanamide?
The canonical SMILES for 3-[3-(furan-3-yl)-1,2,4-oxadiazol-5-yl]-N-(2-piperidin-3-ylethyl)propanamide is O=C(CCc1nc(-c2ccoc2)no1)NCCC1CCCNC1.
What is the InChIKey of 3-[3-(furan-3-yl)-1,2,4-oxadiazol-5-yl]-N-(2-piperidin-3-ylethyl)propanamide?
The InChIKey is LCECRQMKGRPQRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4O3/c21-14(18-8-5-12-2-1-7-17-10-12)3-4-15-19-16(20-23-15)13-6-9-22-11-13/h6,9,11-12,17H,1-5,7-8,10H2,(H,18,21).
What are the key properties of 3-[3-(furan-3-yl)-1,2,4-oxadiazol-5-yl]-N-(2-piperidin-3-ylethyl)propanamide?
3-[3-(furan-3-yl)-1,2,4-oxadiazol-5-yl]-N-(2-piperidin-3-ylethyl)propanamide has a molecular weight of 318.38 g/mol, XLogP of 1.77, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(furan-3-yl)-1,2,4-oxadiazol-5-yl]-N-(2-piperidin-3-ylethyl)propanamide is sourced from PubChem (CID 119555415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).