N-cyclohexyl-N-methyl-2-(2-oxo-5-pyridin-3-yl-1,3,4-oxadiazol-3-yl)acetamide

C16H20N4O3 — CID 16668587

IUPACN-cyclohexyl-N-methyl-2-(2-oxo-5-pyridin-3-yl-1,3,4-oxadiazol-3-yl)acetamide
SMILESCN(C(=O)Cn1nc(-c2cccnc2)oc1=O)C1CCCCC1
InChIInChI=1S/C16H20N4O3/c1-19(13-7-3-2-4-8-13)14(21)11-20-16(22)23-15(18-20)12-6-5-9-17-10-12/h5-6,9-10,13H,2-4,7-8,11H2,1H3
InChIKeyZQPRZABBFVJZLQ-UHFFFAOYSA-N
MW316.36 g/mol
LogP1.69
Rot. Bonds4

About N-cyclohexyl-N-methyl-2-(2-oxo-5-pyridin-3-yl-1,3,4-oxadiazol-3-yl)acetamide

N-cyclohexyl-N-methyl-2-(2-oxo-5-pyridin-3-yl-1,3,4-oxadiazol-3-yl)acetamide (PubChem CID 16668587) has the molecular formula C16H20N4O3 and a molecular weight of 316.36 g/mol. Its IUPAC name is N-cyclohexyl-N-methyl-2-(2-oxo-5-pyridin-3-yl-1,3,4-oxadiazol-3-yl)acetamide.

Molecular Properties

Compound NameN-cyclohexyl-N-methyl-2-(2-oxo-5-pyridin-3-yl-1,3,4-oxadiazol-3-yl)acetamide
PubChem CID16668587
Molecular FormulaC16H20N4O3
Molecular Weight316.36 g/mol
Exact Mass316.15
IUPAC NameN-cyclohexyl-N-methyl-2-(2-oxo-5-pyridin-3-yl-1,3,4-oxadiazol-3-yl)acetamide
SMILESCN(C(=O)Cn1nc(-c2cccnc2)oc1=O)C1CCCCC1
InChIInChI=1S/C16H20N4O3/c1-19(13-7-3-2-4-8-13)14(21)11-20-16(22)23-15(18-20)12-6-5-9-17-10-12/h5-6,9-10,13H,2-4,7-8,11H2,1H3
InChIKeyZQPRZABBFVJZLQ-UHFFFAOYSA-N
XLogP1.69
TPSA81.23 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.36
LogP ≤ 51.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-methyl-2-(2-oxo-5-pyridin-3-yl-1,3,4-oxadiazol-3-yl)acetamide?
The IUPAC name of N-cyclohexyl-N-methyl-2-(2-oxo-5-pyridin-3-yl-1,3,4-oxadiazol-3-yl)acetamide (CID 16668587) is N-cyclohexyl-N-methyl-2-(2-oxo-5-pyridin-3-yl-1,3,4-oxadiazol-3-yl)acetamide.
What is the SMILES notation for N-cyclohexyl-N-methyl-2-(2-oxo-5-pyridin-3-yl-1,3,4-oxadiazol-3-yl)acetamide?
The canonical SMILES for N-cyclohexyl-N-methyl-2-(2-oxo-5-pyridin-3-yl-1,3,4-oxadiazol-3-yl)acetamide is CN(C(=O)Cn1nc(-c2cccnc2)oc1=O)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-N-methyl-2-(2-oxo-5-pyridin-3-yl-1,3,4-oxadiazol-3-yl)acetamide?
The InChIKey is ZQPRZABBFVJZLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O3/c1-19(13-7-3-2-4-8-13)14(21)11-20-16(22)23-15(18-20)12-6-5-9-17-10-12/h5-6,9-10,13H,2-4,7-8,11H2,1H3.
What are the key properties of N-cyclohexyl-N-methyl-2-(2-oxo-5-pyridin-3-yl-1,3,4-oxadiazol-3-yl)acetamide?
N-cyclohexyl-N-methyl-2-(2-oxo-5-pyridin-3-yl-1,3,4-oxadiazol-3-yl)acetamide has a molecular weight of 316.36 g/mol, XLogP of 1.69, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-methyl-2-(2-oxo-5-pyridin-3-yl-1,3,4-oxadiazol-3-yl)acetamide is sourced from PubChem (CID 16668587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).