N-[[5-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]methyl]acetamide

C11H12N4O2 — CID 153383953

IUPACN-[[5-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]methyl]acetamide
SMILESCC(=O)NCc1ccc(-c2noc(C)n2)cn1
InChIInChI=1S/C11H12N4O2/c1-7(16)12-6-10-4-3-9(5-13-10)11-14-8(2)17-15-11/h3-5H,6H2,1-2H3,(H,12,16)
InChIKeyWIQNMIJGRQLDKF-UHFFFAOYSA-N
MW232.24 g/mol
LogP1.08
Rot. Bonds3

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

N-[[5-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]methyl]acetamide (PubChem CID 153383953) has the molecular formula C11H12N4O2 and a molecular weight of 232.24 g/mol. Its IUPAC name is N-[[5-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]methyl]acetamide.

Molecular Properties

Compound NameN-[[5-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]methyl]acetamide
PubChem CID153383953
Molecular FormulaC11H12N4O2
Molecular Weight232.24 g/mol
Exact Mass232.10
IUPAC NameN-[[5-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]methyl]acetamide
SMILESCC(=O)NCc1ccc(-c2noc(C)n2)cn1
InChIInChI=1S/C11H12N4O2/c1-7(16)12-6-10-4-3-9(5-13-10)11-14-8(2)17-15-11/h3-5H,6H2,1-2H3,(H,12,16)
InChIKeyWIQNMIJGRQLDKF-UHFFFAOYSA-N
XLogP1.08
TPSA80.91 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.24
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[[5-(2-cyanophenyl)-2-pyridinyl]methyl]acetamide
CID 143478895
N-[[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]methyl]butanamide
CID 143877601
2-cyclopropyl-N-[[5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]-2-pyridinyl]methyl]acetamide
CID 137366430
N-[4-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]phenyl]acetamide
CID 890855
N-methyl-2-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]acetamide
CID 47119130
1-(4-fluorophenyl)-3-[[5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]-2-pyridinyl]methyl]urea
CID 151255198
[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl] acetate
CID 154709033
N-[[5-[5-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-3-yl]thiophen-2-yl]methyl]acetamide
CID 53126019
1-cyclopropyl-3-[[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]methyl]urea
CID 166265848
(5-fluoro-2-pyridinyl)methanamine;N-[(5-fluoro-2-pyridinyl)methyl]acetamide
CID 160901268
N-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]acetamide
CID 6459027
3-[[5-[5-[4-(2-methylpropyl)phenyl]-1,2,4-oxadiazol-3-yl]-2-pyridinyl]methylamino]cyclobutane-1-carboxylic acid
CID 24895474

Frequently Asked Questions

What is the IUPAC name of N-[[5-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]methyl]acetamide?
The IUPAC name of N-[[5-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]methyl]acetamide (CID 153383953) is N-[[5-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]methyl]acetamide.
What is the SMILES notation for N-[[5-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]methyl]acetamide?
The canonical SMILES for N-[[5-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]methyl]acetamide is CC(=O)NCc1ccc(-c2noc(C)n2)cn1.
What is the InChIKey of N-[[5-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]methyl]acetamide?
The InChIKey is WIQNMIJGRQLDKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O2/c1-7(16)12-6-10-4-3-9(5-13-10)11-14-8(2)17-15-11/h3-5H,6H2,1-2H3,(H,12,16).
What are the key properties of N-[[5-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]methyl]acetamide?
N-[[5-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]methyl]acetamide has a molecular weight of 232.24 g/mol, XLogP of 1.08, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]methyl]acetamide is sourced from PubChem (CID 153383953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).