2-phenyl-2-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)ethanamine

C15H14N4O — CID 82020898

IUPAC2-phenyl-2-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)ethanamine
SMILESNCC(c1ccccc1)c1nnc(-c2ccccn2)o1
InChIInChI=1S/C15H14N4O/c16-10-12(11-6-2-1-3-7-11)14-18-19-15(20-14)13-8-4-5-9-17-13/h1-9,12H,10,16H2
InChIKeyQVMGEQWSEFFJOZ-UHFFFAOYSA-N
MW266.30 g/mol
LogP2.22
Rot. Bonds4

About 2-phenyl-2-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)ethanamine

2-phenyl-2-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)ethanamine (PubChem CID 82020898) has the molecular formula C15H14N4O and a molecular weight of 266.30 g/mol. Its IUPAC name is 2-phenyl-2-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)ethanamine.

Molecular Properties

Compound Name2-phenyl-2-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)ethanamine
PubChem CID82020898
Molecular FormulaC15H14N4O
Molecular Weight266.30 g/mol
Exact Mass266.12
IUPAC Name2-phenyl-2-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)ethanamine
SMILESNCC(c1ccccc1)c1nnc(-c2ccccn2)o1
InChIInChI=1S/C15H14N4O/c16-10-12(11-6-2-1-3-7-11)14-18-19-15(20-14)13-8-4-5-9-17-13/h1-9,12H,10,16H2
InChIKeyQVMGEQWSEFFJOZ-UHFFFAOYSA-N
XLogP2.22
TPSA77.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[chloro(phenyl)methyl]-5-pyridin-2-yl-1,3,4-oxadiazole
CID 43245591
2-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-2-phenylethanamine
CID 82020897
N-ethyl-1-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)propan-1-amine
CID 55124400
2-benzyl-5-pyridin-2-yl-1,3,4-oxadiazole
CID 156786960
2-benzylsulfinyl-5-pyridin-2-yl-1,3,4-oxadiazole
CID 10401673
2-phenyl-2-(5-pyridin-2-yl-1H-imidazol-2-yl)ethanamine
CID 62878389
2-(4-fluorophenyl)-2-pyridin-2-ylethanamine
CID 82040232
O-[2-[(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]ethyl]hydroxylamine
CID 139680379
2-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)ethanol
CID 83530769
2-benzhydryl-5-(5-benzhydryl-1,3,4-oxadiazol-2-yl)-1,3,4-oxadiazole
CID 3576831
3-[(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]propanoic acid
CID 1467896
2-(6-pyridin-2-yl-2-pyridinyl)-5-[6-[5-(6-pyridin-2-yl-2-pyridinyl)-1,3,4-oxadiazol-2-yl]-2-pyridinyl]-1,3,4-oxadiazole
CID 59514881

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-2-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)ethanamine?
The IUPAC name of 2-phenyl-2-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)ethanamine (CID 82020898) is 2-phenyl-2-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)ethanamine.
What is the SMILES notation for 2-phenyl-2-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)ethanamine?
The canonical SMILES for 2-phenyl-2-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)ethanamine is NCC(c1ccccc1)c1nnc(-c2ccccn2)o1.
What is the InChIKey of 2-phenyl-2-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)ethanamine?
The InChIKey is QVMGEQWSEFFJOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O/c16-10-12(11-6-2-1-3-7-11)14-18-19-15(20-14)13-8-4-5-9-17-13/h1-9,12H,10,16H2.
What are the key properties of 2-phenyl-2-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)ethanamine?
2-phenyl-2-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)ethanamine has a molecular weight of 266.30 g/mol, XLogP of 2.22, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-2-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)ethanamine is sourced from PubChem (CID 82020898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).