2-(5-ethyl-1,2,4-oxadiazol-3-yl)-N-[2-(4-hydroxyphenyl)ethyl]acetamide

C14H17N3O3 — CID 143940575

IUPAC2-(5-ethyl-1,2,4-oxadiazol-3-yl)-N-[2-(4-hydroxyphenyl)ethyl]acetamide
SMILESCCc1nc(CC(=O)NCCc2ccc(O)cc2)no1
InChIInChI=1S/C14H17N3O3/c1-2-14-16-12(17-20-14)9-13(19)15-8-7-10-3-5-11(18)6-4-10/h3-6,18H,2,7-9H2,1H3,(H,15,19)
InChIKeyBSSTXHUFNKDFPW-UHFFFAOYSA-N
MW275.31 g/mol
LogP1.24
Rot. Bonds6

About 2-(5-ethyl-1,2,4-oxadiazol-3-yl)-N-[2-(4-hydroxyphenyl)ethyl]acetamide

2-(5-ethyl-1,2,4-oxadiazol-3-yl)-N-[2-(4-hydroxyphenyl)ethyl]acetamide (PubChem CID 143940575) has the molecular formula C14H17N3O3 and a molecular weight of 275.31 g/mol. Its IUPAC name is 2-(5-ethyl-1,2,4-oxadiazol-3-yl)-N-[2-(4-hydroxyphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(5-ethyl-1,2,4-oxadiazol-3-yl)-N-[2-(4-hydroxyphenyl)ethyl]acetamide
PubChem CID143940575
Molecular FormulaC14H17N3O3
Molecular Weight275.31 g/mol
Exact Mass275.13
IUPAC Name2-(5-ethyl-1,2,4-oxadiazol-3-yl)-N-[2-(4-hydroxyphenyl)ethyl]acetamide
SMILESCCc1nc(CC(=O)NCCc2ccc(O)cc2)no1
InChIInChI=1S/C14H17N3O3/c1-2-14-16-12(17-20-14)9-13(19)15-8-7-10-3-5-11(18)6-4-10/h3-6,18H,2,7-9H2,1H3,(H,15,19)
InChIKeyBSSTXHUFNKDFPW-UHFFFAOYSA-N
XLogP1.24
TPSA88.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.31
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-(5-ethyl-1,2,4-oxadiazol-3-yl)propan-2-one
CID 12955452
N-[2-(4-hydroxyphenyl)ethyl]-2-phenylacetamide
CID 11857553
2-(5,7-dimethyl-1,2-benzoxazol-3-yl)-N-[2-(4-hydroxyphenyl)ethyl]acetamide
CID 108794494
N-[2-(4-hydroxyphenyl)ethyl]hexanamide
CID 21446637
(3R)-N-[2-(5-ethyl-1,2,4-oxadiazol-3-yl)ethyl]-3-(2-fluorophenyl)-3-phenylpropanamide
CID 97270529
N-[2-(5-ethyl-1,2,4-oxadiazol-3-yl)ethyl]-3-(2-fluorophenyl)-3-phenylpropanamide
CID 72850665
N-[2-(4-methylphenyl)ethyl]-3-[3-[(4-methylphenyl)sulfonylmethyl]-1,2,4-oxadiazol-5-yl]propanamide
CID 46355067
1-[2-(4-chlorophenyl)ethyl]-3-[4-(5-ethyl-1,2,4-oxadiazol-3-yl)phenyl]urea
CID 50778245
3-amino-N-[2-[4-(3-ethyl-1,2,4-oxadiazol-5-yl)phenyl]ethyl]propanamide;hydrochloride
CID 119317568
N-[2-(3-ethyl-1,2,4-oxadiazol-5-yl)ethyl]-3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanamide
CID 70770521
4-[2-[3-(3-methyl-1,2,4-oxadiazol-5-yl)propanoylamino]ethyl]benzoic acid
CID 119168608
1-[4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]propan-2-one
CID 115495429

Frequently Asked Questions

What is the IUPAC name of 2-(5-ethyl-1,2,4-oxadiazol-3-yl)-N-[2-(4-hydroxyphenyl)ethyl]acetamide?
The IUPAC name of 2-(5-ethyl-1,2,4-oxadiazol-3-yl)-N-[2-(4-hydroxyphenyl)ethyl]acetamide (CID 143940575) is 2-(5-ethyl-1,2,4-oxadiazol-3-yl)-N-[2-(4-hydroxyphenyl)ethyl]acetamide.
What is the SMILES notation for 2-(5-ethyl-1,2,4-oxadiazol-3-yl)-N-[2-(4-hydroxyphenyl)ethyl]acetamide?
The canonical SMILES for 2-(5-ethyl-1,2,4-oxadiazol-3-yl)-N-[2-(4-hydroxyphenyl)ethyl]acetamide is CCc1nc(CC(=O)NCCc2ccc(O)cc2)no1.
What is the InChIKey of 2-(5-ethyl-1,2,4-oxadiazol-3-yl)-N-[2-(4-hydroxyphenyl)ethyl]acetamide?
The InChIKey is BSSTXHUFNKDFPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O3/c1-2-14-16-12(17-20-14)9-13(19)15-8-7-10-3-5-11(18)6-4-10/h3-6,18H,2,7-9H2,1H3,(H,15,19).
What are the key properties of 2-(5-ethyl-1,2,4-oxadiazol-3-yl)-N-[2-(4-hydroxyphenyl)ethyl]acetamide?
2-(5-ethyl-1,2,4-oxadiazol-3-yl)-N-[2-(4-hydroxyphenyl)ethyl]acetamide has a molecular weight of 275.31 g/mol, XLogP of 1.24, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-ethyl-1,2,4-oxadiazol-3-yl)-N-[2-(4-hydroxyphenyl)ethyl]acetamide is sourced from PubChem (CID 143940575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).