5-(4-morpholin-4-ylphenyl)-1,3,4-oxadiazol-2-amine

C12H14N4O2 — CID 138736841

IUPAC5-(4-morpholin-4-ylphenyl)-1,3,4-oxadiazol-2-amine
SMILESNc1nnc(-c2ccc(N3CCOCC3)cc2)o1
InChIInChI=1S/C12H14N4O2/c13-12-15-14-11(18-12)9-1-3-10(4-2-9)16-5-7-17-8-6-16/h1-4H,5-8H2,(H2,13,15)
InChIKeySUZWPIVDXLFSFJ-UHFFFAOYSA-N
MW246.27 g/mol
LogP1.16
Rot. Bonds2

About 5-(4-morpholin-4-ylphenyl)-1,3,4-oxadiazol-2-amine

5-(4-morpholin-4-ylphenyl)-1,3,4-oxadiazol-2-amine (PubChem CID 138736841) has the molecular formula C12H14N4O2 and a molecular weight of 246.27 g/mol. Its IUPAC name is 5-(4-morpholin-4-ylphenyl)-1,3,4-oxadiazol-2-amine.

Molecular Properties

Compound Name5-(4-morpholin-4-ylphenyl)-1,3,4-oxadiazol-2-amine
PubChem CID138736841
Molecular FormulaC12H14N4O2
Molecular Weight246.27 g/mol
Exact Mass246.11
IUPAC Name5-(4-morpholin-4-ylphenyl)-1,3,4-oxadiazol-2-amine
SMILESNc1nnc(-c2ccc(N3CCOCC3)cc2)o1
InChIInChI=1S/C12H14N4O2/c13-12-15-14-11(18-12)9-1-3-10(4-2-9)16-5-7-17-8-6-16/h1-4H,5-8H2,(H2,13,15)
InChIKeySUZWPIVDXLFSFJ-UHFFFAOYSA-N
XLogP1.16
TPSA77.41 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.27
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

13-[4-[4-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)phenyl]phenyl]-1,4,7,10-tetraoxa-13-azacyclopentadecane
CID 102533214
4-(4-pyridin-4-ylphenyl)morpholine
CID 91005781
4-[4-[5-[2-(4-morpholin-4-ylphenyl)-3H-benzimidazol-5-yl]-1,3,4-oxadiazol-2-yl]phenyl]morpholine
CID 67114161
4-[5-(4-propan-2-ylphenyl)-1,3,4-oxadiazol-2-yl]morpholine
CID 146568100
(4-morpholin-4-ylphenyl)-[4-(4-morpholin-4-ylphenyl)phenyl]diazene
CID 118528758
4-(4-pyrrolidin-1-ylphenyl)morpholine
CID 67305085
5-(4-ethylphenyl)-1,3,4-oxadiazol-2-amine
CID 18073044
16-(4-methylphenyl)-1,4,7,10,13-pentaoxa-16-azacyclooctadecane
CID 71419396
4-[4-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]phenyl]morpholine
CID 50769427
[4-(4-morpholin-4-ylphenyl)-2-pyridinyl]methanamine
CID 177019277
4-[4-(2H-tetrazol-5-yl)phenyl]morpholine
CID 863212
5-[4-(4-chlorophenyl)piperazin-1-yl]-1,3,4-oxadiazol-2-amine
CID 103436524

Frequently Asked Questions

What is the IUPAC name of 5-(4-morpholin-4-ylphenyl)-1,3,4-oxadiazol-2-amine?
The IUPAC name of 5-(4-morpholin-4-ylphenyl)-1,3,4-oxadiazol-2-amine (CID 138736841) is 5-(4-morpholin-4-ylphenyl)-1,3,4-oxadiazol-2-amine.
What is the SMILES notation for 5-(4-morpholin-4-ylphenyl)-1,3,4-oxadiazol-2-amine?
The canonical SMILES for 5-(4-morpholin-4-ylphenyl)-1,3,4-oxadiazol-2-amine is Nc1nnc(-c2ccc(N3CCOCC3)cc2)o1.
What is the InChIKey of 5-(4-morpholin-4-ylphenyl)-1,3,4-oxadiazol-2-amine?
The InChIKey is SUZWPIVDXLFSFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O2/c13-12-15-14-11(18-12)9-1-3-10(4-2-9)16-5-7-17-8-6-16/h1-4H,5-8H2,(H2,13,15).
What are the key properties of 5-(4-morpholin-4-ylphenyl)-1,3,4-oxadiazol-2-amine?
5-(4-morpholin-4-ylphenyl)-1,3,4-oxadiazol-2-amine has a molecular weight of 246.27 g/mol, XLogP of 1.16, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-morpholin-4-ylphenyl)-1,3,4-oxadiazol-2-amine is sourced from PubChem (CID 138736841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).