N-propan-2-yl-2-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)phenoxy]acetamide

C16H21N3O3 — CID 25238336

IUPACN-propan-2-yl-2-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)phenoxy]acetamide
SMILESCC(C)NC(=O)COc1ccc(-c2nc(C(C)C)no2)cc1
InChIInChI=1S/C16H21N3O3/c1-10(2)15-18-16(22-19-15)12-5-7-13(8-6-12)21-9-14(20)17-11(3)4/h5-8,10-11H,9H2,1-4H3,(H,17,20)
InChIKeyDDDQLVSUZCWSBD-UHFFFAOYSA-N
MW303.36 g/mol
LogP2.76
Rot. Bonds6

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

N-propan-2-yl-2-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)phenoxy]acetamide (PubChem CID 25238336) has the molecular formula C16H21N3O3 and a molecular weight of 303.36 g/mol. Its IUPAC name is N-propan-2-yl-2-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)phenoxy]acetamide.

Molecular Properties

Compound NameN-propan-2-yl-2-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)phenoxy]acetamide
PubChem CID25238336
Molecular FormulaC16H21N3O3
Molecular Weight303.36 g/mol
Exact Mass303.16
IUPAC NameN-propan-2-yl-2-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)phenoxy]acetamide
SMILESCC(C)NC(=O)COc1ccc(-c2nc(C(C)C)no2)cc1
InChIInChI=1S/C16H21N3O3/c1-10(2)15-18-16(22-19-15)12-5-7-13(8-6-12)21-9-14(20)17-11(3)4/h5-8,10-11H,9H2,1-4H3,(H,17,20)
InChIKeyDDDQLVSUZCWSBD-UHFFFAOYSA-N
XLogP2.76
TPSA77.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.36
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-2-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)phenoxy]acetamide?
The IUPAC name of N-propan-2-yl-2-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)phenoxy]acetamide (CID 25238336) is N-propan-2-yl-2-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)phenoxy]acetamide.
What is the SMILES notation for N-propan-2-yl-2-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)phenoxy]acetamide?
The canonical SMILES for N-propan-2-yl-2-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)phenoxy]acetamide is CC(C)NC(=O)COc1ccc(-c2nc(C(C)C)no2)cc1.
What is the InChIKey of N-propan-2-yl-2-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)phenoxy]acetamide?
The InChIKey is DDDQLVSUZCWSBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O3/c1-10(2)15-18-16(22-19-15)12-5-7-13(8-6-12)21-9-14(20)17-11(3)4/h5-8,10-11H,9H2,1-4H3,(H,17,20).
What are the key properties of N-propan-2-yl-2-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)phenoxy]acetamide?
N-propan-2-yl-2-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)phenoxy]acetamide has a molecular weight of 303.36 g/mol, XLogP of 2.76, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-2-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)phenoxy]acetamide is sourced from PubChem (CID 25238336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).