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

C13H16N4O2 — CID 60695092

IUPACN-ethyl-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylamino]acetamide
SMILESCCNC(=O)CNCc1nnc(-c2ccccc2)o1
InChIInChI=1S/C13H16N4O2/c1-2-15-11(18)8-14-9-12-16-17-13(19-12)10-6-4-3-5-7-10/h3-7,14H,2,8-9H2,1H3,(H,15,18)
InChIKeyOBYGNESWIKKODT-UHFFFAOYSA-N
MW260.30 g/mol
LogP0.96
Rot. Bonds6

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

N-ethyl-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylamino]acetamide (PubChem CID 60695092) has the molecular formula C13H16N4O2 and a molecular weight of 260.30 g/mol. Its IUPAC name is N-ethyl-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylamino]acetamide.

Molecular Properties

Compound NameN-ethyl-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylamino]acetamide
PubChem CID60695092
Molecular FormulaC13H16N4O2
Molecular Weight260.30 g/mol
Exact Mass260.13
IUPAC NameN-ethyl-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylamino]acetamide
SMILESCCNC(=O)CNCc1nnc(-c2ccccc2)o1
InChIInChI=1S/C13H16N4O2/c1-2-15-11(18)8-14-9-12-16-17-13(19-12)10-6-4-3-5-7-10/h3-7,14H,2,8-9H2,1H3,(H,15,18)
InChIKeyOBYGNESWIKKODT-UHFFFAOYSA-N
XLogP0.96
TPSA80.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.30
LogP ≤ 50.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-2-(5-phenyl-1,3,4-oxadiazol-2-yl)acetamide
CID 46249412
2,2-dimethyl-3-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylamino]propanamide
CID 106276224
2-[(3R)-oxolan-3-yl]-N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]acetamide
CID 126446607
1-phenyl-3-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]urea
CID 110318453
2-(2-methoxyphenoxy)-N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]acetamide
CID 110318462
N-[2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylamino]ethyl]cyclopropanecarboxamide
CID 115571323
N-ethyl-2-[(5-phenylthiophen-2-yl)methylamino]acetamide
CID 43223958
2-phenyl-5-propyl-1,3,4-oxadiazole
CID 14949000
2-(oxan-2-yl)-N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]acetamide
CID 110606908
2-ethyl-5-phenyl-1,3,4-oxadiazole
CID 12520828
1-(4-methylphenyl)-N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]methanamine
CID 18870633
N-ethyl-2-[(4-phenylthiophen-2-yl)methylamino]acetamide
CID 54903925

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylamino]acetamide?
The IUPAC name of N-ethyl-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylamino]acetamide (CID 60695092) is N-ethyl-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylamino]acetamide.
What is the SMILES notation for N-ethyl-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylamino]acetamide?
The canonical SMILES for N-ethyl-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylamino]acetamide is CCNC(=O)CNCc1nnc(-c2ccccc2)o1.
What is the InChIKey of N-ethyl-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylamino]acetamide?
The InChIKey is OBYGNESWIKKODT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O2/c1-2-15-11(18)8-14-9-12-16-17-13(19-12)10-6-4-3-5-7-10/h3-7,14H,2,8-9H2,1H3,(H,15,18).
What are the key properties of N-ethyl-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylamino]acetamide?
N-ethyl-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylamino]acetamide has a molecular weight of 260.30 g/mol, XLogP of 0.96, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylamino]acetamide is sourced from PubChem (CID 60695092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).