4-[[5-(4-morpholin-4-ylphenyl)-1,3-oxazol-2-yl]amino]phenol

C19H19N3O3 — CID 46880502

IUPAC4-[[5-(4-morpholin-4-ylphenyl)-1,3-oxazol-2-yl]amino]phenol
SMILESOc1ccc(Nc2ncc(-c3ccc(N4CCOCC4)cc3)o2)cc1
InChIInChI=1S/C19H19N3O3/c23-17-7-3-15(4-8-17)21-19-20-13-18(25-19)14-1-5-16(6-2-14)22-9-11-24-12-10-22/h1-8,13,23H,9-12H2,(H,20,21)
InChIKeySWMSZCBNNWCBPL-UHFFFAOYSA-N
MW337.38 g/mol
LogP3.63
Rot. Bonds4

About 4-[[5-(4-morpholin-4-ylphenyl)-1,3-oxazol-2-yl]amino]phenol

4-[[5-(4-morpholin-4-ylphenyl)-1,3-oxazol-2-yl]amino]phenol (PubChem CID 46880502) has the molecular formula C19H19N3O3 and a molecular weight of 337.38 g/mol. Its IUPAC name is 4-[[5-(4-morpholin-4-ylphenyl)-1,3-oxazol-2-yl]amino]phenol.

Molecular Properties

Compound Name4-[[5-(4-morpholin-4-ylphenyl)-1,3-oxazol-2-yl]amino]phenol
PubChem CID46880502
Molecular FormulaC19H19N3O3
Molecular Weight337.38 g/mol
Exact Mass337.14
IUPAC Name4-[[5-(4-morpholin-4-ylphenyl)-1,3-oxazol-2-yl]amino]phenol
SMILESOc1ccc(Nc2ncc(-c3ccc(N4CCOCC4)cc3)o2)cc1
InChIInChI=1S/C19H19N3O3/c23-17-7-3-15(4-8-17)21-19-20-13-18(25-19)14-1-5-16(6-2-14)22-9-11-24-12-10-22/h1-8,13,23H,9-12H2,(H,20,21)
InChIKeySWMSZCBNNWCBPL-UHFFFAOYSA-N
XLogP3.63
TPSA70.76 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 53.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroquinone', 'substructure': 'N/A'}

Analyze 4-[[5-(4-morpholin-4-ylphenyl)-1,3-oxazol-2-yl]amino]phenol with MolForge

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Related Compounds

N,5-Diphenyl-2-oxazolamine
CID 5329404
N-(2-methoxyphenyl)-5-phenyl-1,3-oxazol-2-amine
CID 5329844
3-(5-Phenyl-oxazol-2-ylamino)phenylmethanol
CID 5329847
N-(3,4-dimethoxyphenyl)-5-phenyl-1,3-oxazol-2-amine
CID 5329852
N-(4-phenoxyphenyl)-5-phenyl-1,3-oxazol-2-amine
CID 5329851
N-(3-phenoxyphenyl)-5-phenyl-1,3-oxazol-2-amine
CID 5329846
{(S)-1-[4-(3-Methoxy-4-oxazol-5-yl-phenylamino)-6-methylamino-[1,3,5]triazin-2-yl]-pyrrolidin-2-yl}-methanol
CID 10126668
N''''-cyano-N-[3-(hydroxymethyl)phenyl]-N''-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]guanidine
CID 10292172
2-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-4-N-methyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
CID 10309428
8-{5-[4-(Pyrrolidin-1-yl)phenyl]oxazol-2-ylamino}-1,2,3,4-tetrahydronaphthalen-2-ol
CID 11964260
2-Methoxy-4-(5-phenyl-oxazol-2-ylamino)-benzonitrile
CID 18184806
{(R)-1-[4-(3-Methoxy-4-oxazol-5-yl-phenylamino)-6-methylamino-[1,3,5]triazin-2-yl]-pyrrolidin-2-yl}-methanol
CID 44308165

Frequently Asked Questions

What is the IUPAC name of 4-[[5-(4-morpholin-4-ylphenyl)-1,3-oxazol-2-yl]amino]phenol?
The IUPAC name of 4-[[5-(4-morpholin-4-ylphenyl)-1,3-oxazol-2-yl]amino]phenol (CID 46880502) is 4-[[5-(4-morpholin-4-ylphenyl)-1,3-oxazol-2-yl]amino]phenol.
What is the SMILES notation for 4-[[5-(4-morpholin-4-ylphenyl)-1,3-oxazol-2-yl]amino]phenol?
The canonical SMILES for 4-[[5-(4-morpholin-4-ylphenyl)-1,3-oxazol-2-yl]amino]phenol is Oc1ccc(Nc2ncc(-c3ccc(N4CCOCC4)cc3)o2)cc1.
What is the InChIKey of 4-[[5-(4-morpholin-4-ylphenyl)-1,3-oxazol-2-yl]amino]phenol?
The InChIKey is SWMSZCBNNWCBPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O3/c23-17-7-3-15(4-8-17)21-19-20-13-18(25-19)14-1-5-16(6-2-14)22-9-11-24-12-10-22/h1-8,13,23H,9-12H2,(H,20,21).
What are the key properties of 4-[[5-(4-morpholin-4-ylphenyl)-1,3-oxazol-2-yl]amino]phenol?
4-[[5-(4-morpholin-4-ylphenyl)-1,3-oxazol-2-yl]amino]phenol has a molecular weight of 337.38 g/mol, XLogP of 3.63, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[5-(4-morpholin-4-ylphenyl)-1,3-oxazol-2-yl]amino]phenol is sourced from PubChem (CID 46880502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).