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

C18H24N4O3 — CID 71968872

IUPACN-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cycloheptyl]-2-(3-methyl-2-oxo-1-pyridinyl)acetamide
SMILESCc1nc(C2(NC(=O)Cn3cccc(C)c3=O)CCCCCC2)no1
InChIInChI=1S/C18H24N4O3/c1-13-8-7-11-22(16(13)24)12-15(23)20-18(9-5-3-4-6-10-18)17-19-14(2)25-21-17/h7-8,11H,3-6,9-10,12H2,1-2H3,(H,20,23)
InChIKeyMUNDKPKNNJSZJP-UHFFFAOYSA-N
MW344.42 g/mol
LogP2.21
Rot. Bonds4

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

N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cycloheptyl]-2-(3-methyl-2-oxo-1-pyridinyl)acetamide (PubChem CID 71968872) has the molecular formula C18H24N4O3 and a molecular weight of 344.42 g/mol. Its IUPAC name is N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cycloheptyl]-2-(3-methyl-2-oxo-1-pyridinyl)acetamide.

Molecular Properties

Compound NameN-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cycloheptyl]-2-(3-methyl-2-oxo-1-pyridinyl)acetamide
PubChem CID71968872
Molecular FormulaC18H24N4O3
Molecular Weight344.42 g/mol
Exact Mass344.18
IUPAC NameN-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cycloheptyl]-2-(3-methyl-2-oxo-1-pyridinyl)acetamide
SMILESCc1nc(C2(NC(=O)Cn3cccc(C)c3=O)CCCCCC2)no1
InChIInChI=1S/C18H24N4O3/c1-13-8-7-11-22(16(13)24)12-15(23)20-18(9-5-3-4-6-10-18)17-19-14(2)25-21-17/h7-8,11H,3-6,9-10,12H2,1-2H3,(H,20,23)
InChIKeyMUNDKPKNNJSZJP-UHFFFAOYSA-N
XLogP2.21
TPSA90.02 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.42
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cycloheptyl]-2-(3-methyl-2-oxo-1-pyridinyl)acetamide?
The IUPAC name of N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cycloheptyl]-2-(3-methyl-2-oxo-1-pyridinyl)acetamide (CID 71968872) is N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cycloheptyl]-2-(3-methyl-2-oxo-1-pyridinyl)acetamide.
What is the SMILES notation for N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cycloheptyl]-2-(3-methyl-2-oxo-1-pyridinyl)acetamide?
The canonical SMILES for N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cycloheptyl]-2-(3-methyl-2-oxo-1-pyridinyl)acetamide is Cc1nc(C2(NC(=O)Cn3cccc(C)c3=O)CCCCCC2)no1.
What is the InChIKey of N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cycloheptyl]-2-(3-methyl-2-oxo-1-pyridinyl)acetamide?
The InChIKey is MUNDKPKNNJSZJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O3/c1-13-8-7-11-22(16(13)24)12-15(23)20-18(9-5-3-4-6-10-18)17-19-14(2)25-21-17/h7-8,11H,3-6,9-10,12H2,1-2H3,(H,20,23).
What are the key properties of N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cycloheptyl]-2-(3-methyl-2-oxo-1-pyridinyl)acetamide?
N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cycloheptyl]-2-(3-methyl-2-oxo-1-pyridinyl)acetamide has a molecular weight of 344.42 g/mol, XLogP of 2.21, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cycloheptyl]-2-(3-methyl-2-oxo-1-pyridinyl)acetamide is sourced from PubChem (CID 71968872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).