N-(4-propan-2-yloxyphenyl)-3-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)propanamide

C19H20N4O3 — CID 110330322

IUPACN-(4-propan-2-yloxyphenyl)-3-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)propanamide
SMILESCC(C)Oc1ccc(NC(=O)CCc2nnc(-c3ccccn3)o2)cc1
InChIInChI=1S/C19H20N4O3/c1-13(2)25-15-8-6-14(7-9-15)21-17(24)10-11-18-22-23-19(26-18)16-5-3-4-12-20-16/h3-9,12-13H,10-11H2,1-2H3,(H,21,24)
InChIKeyVYEXKVIOUNAJPI-UHFFFAOYSA-N
MW352.39 g/mol
LogP3.49
Rot. Bonds7

About N-(4-propan-2-yloxyphenyl)-3-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)propanamide

N-(4-propan-2-yloxyphenyl)-3-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)propanamide (PubChem CID 110330322) has the molecular formula C19H20N4O3 and a molecular weight of 352.39 g/mol. Its IUPAC name is N-(4-propan-2-yloxyphenyl)-3-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)propanamide.

Molecular Properties

Compound NameN-(4-propan-2-yloxyphenyl)-3-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)propanamide
PubChem CID110330322
Molecular FormulaC19H20N4O3
Molecular Weight352.39 g/mol
Exact Mass352.15
IUPAC NameN-(4-propan-2-yloxyphenyl)-3-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)propanamide
SMILESCC(C)Oc1ccc(NC(=O)CCc2nnc(-c3ccccn3)o2)cc1
InChIInChI=1S/C19H20N4O3/c1-13(2)25-15-8-6-14(7-9-15)21-17(24)10-11-18-22-23-19(26-18)16-5-3-4-12-20-16/h3-9,12-13H,10-11H2,1-2H3,(H,21,24)
InChIKeyVYEXKVIOUNAJPI-UHFFFAOYSA-N
XLogP3.49
TPSA90.14 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.39
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-phenyl-3-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)propanamide
CID 110330293
N-(3-bromo-4-methylphenyl)-3-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)propanamide
CID 110330318
N-(3-chlorophenyl)-3-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)propanamide
CID 110330310
N-(2-fluorophenyl)-3-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)propanamide
CID 110330308
N-butyl-3-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)propanamide
CID 110330217
N-(4-ethoxyphenyl)-3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)propanamide
CID 110335290
N-(2-phenylethyl)-3-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)propanamide
CID 110330251
2-(4-methylphenoxy)-N-[2-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)ethyl]acetamide
CID 110320557
N,N'-bis(4-propan-2-yloxyphenyl)butanediamide
CID 17340345
methyl 5-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)pentanoate
CID 59027826
2-methyl-N-[(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)methyl]propanamide
CID 110318515
3-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(4-phenoxyphenyl)propanamide
CID 110333704

Frequently Asked Questions

What is the IUPAC name of N-(4-propan-2-yloxyphenyl)-3-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)propanamide?
The IUPAC name of N-(4-propan-2-yloxyphenyl)-3-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)propanamide (CID 110330322) is N-(4-propan-2-yloxyphenyl)-3-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)propanamide.
What is the SMILES notation for N-(4-propan-2-yloxyphenyl)-3-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)propanamide?
The canonical SMILES for N-(4-propan-2-yloxyphenyl)-3-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)propanamide is CC(C)Oc1ccc(NC(=O)CCc2nnc(-c3ccccn3)o2)cc1.
What is the InChIKey of N-(4-propan-2-yloxyphenyl)-3-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)propanamide?
The InChIKey is VYEXKVIOUNAJPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O3/c1-13(2)25-15-8-6-14(7-9-15)21-17(24)10-11-18-22-23-19(26-18)16-5-3-4-12-20-16/h3-9,12-13H,10-11H2,1-2H3,(H,21,24).
What are the key properties of N-(4-propan-2-yloxyphenyl)-3-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)propanamide?
N-(4-propan-2-yloxyphenyl)-3-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)propanamide has a molecular weight of 352.39 g/mol, XLogP of 3.49, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-propan-2-yloxyphenyl)-3-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)propanamide is sourced from PubChem (CID 110330322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).