5-(3,5-dichlorophenyl)-4-pyridin-2-yl-1,2-oxazol-3-amine

C14H9Cl2N3O — CID 80521472

IUPAC5-(3,5-dichlorophenyl)-4-pyridin-2-yl-1,2-oxazol-3-amine
SMILESNc1noc(-c2cc(Cl)cc(Cl)c2)c1-c1ccccn1
InChIInChI=1S/C14H9Cl2N3O/c15-9-5-8(6-10(16)7-9)13-12(14(17)19-20-13)11-3-1-2-4-18-11/h1-7H,(H2,17,19)
InChIKeyOADBRMUSLODULB-UHFFFAOYSA-N
MW306.15 g/mol
LogP4.29
Rot. Bonds2

About 5-(3,5-dichlorophenyl)-4-pyridin-2-yl-1,2-oxazol-3-amine

5-(3,5-dichlorophenyl)-4-pyridin-2-yl-1,2-oxazol-3-amine (PubChem CID 80521472) has the molecular formula C14H9Cl2N3O and a molecular weight of 306.15 g/mol. Its IUPAC name is 5-(3,5-dichlorophenyl)-4-pyridin-2-yl-1,2-oxazol-3-amine.

Molecular Properties

Compound Name5-(3,5-dichlorophenyl)-4-pyridin-2-yl-1,2-oxazol-3-amine
PubChem CID80521472
Molecular FormulaC14H9Cl2N3O
Molecular Weight306.15 g/mol
Exact Mass305.01
IUPAC Name5-(3,5-dichlorophenyl)-4-pyridin-2-yl-1,2-oxazol-3-amine
SMILESNc1noc(-c2cc(Cl)cc(Cl)c2)c1-c1ccccn1
InChIInChI=1S/C14H9Cl2N3O/c15-9-5-8(6-10(16)7-9)13-12(14(17)19-20-13)11-3-1-2-4-18-11/h1-7H,(H2,17,19)
InChIKeyOADBRMUSLODULB-UHFFFAOYSA-N
XLogP4.29
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.15
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(3-chloro-4-methylphenyl)-4-pyridin-2-yl-1,2-oxazol-3-amine
CID 80522847
5-(4-bromo-3-chlorophenyl)-4-pyridin-2-yl-1,2-oxazol-3-amine
CID 81307029
5-(3-chloro-4-iodophenyl)-4-pyridin-2-yl-1,2-oxazol-3-amine
CID 103222608
5-(3-fluoro-4-methylphenyl)-4-pyridin-2-yl-1,2-oxazol-3-amine
CID 80522275
5-(4-chloro-2-methoxyphenyl)-4-pyridin-2-yl-1,2-oxazol-3-amine
CID 80521231
4-(3,5-difluorophenyl)-5-pyridin-2-yl-1,2-oxazol-3-amine
CID 66201880
5-(3-amino-4-pyridin-2-yl-1,2-oxazol-5-yl)-1H-pyridin-2-one
CID 136742866
5-(3-chlorophenyl)-4-phenyl-1,2-oxazol-3-amine
CID 66199504
5-(3-chloro-5-methylphenyl)-4-phenyl-1,2-oxazol-3-amine
CID 81324835
5-(2,3-dimethylphenyl)-4-pyridin-2-yl-1,2-oxazol-3-amine
CID 80521578
5-(3-bromo-5-chlorophenyl)-4-(2-chlorophenyl)-1,2-oxazol-3-amine
CID 107954780
5-(4-chlorophenyl)-4-phenyl-1,2-oxazol-3-amine
CID 66200717

Frequently Asked Questions

What is the IUPAC name of 5-(3,5-dichlorophenyl)-4-pyridin-2-yl-1,2-oxazol-3-amine?
The IUPAC name of 5-(3,5-dichlorophenyl)-4-pyridin-2-yl-1,2-oxazol-3-amine (CID 80521472) is 5-(3,5-dichlorophenyl)-4-pyridin-2-yl-1,2-oxazol-3-amine.
What is the SMILES notation for 5-(3,5-dichlorophenyl)-4-pyridin-2-yl-1,2-oxazol-3-amine?
The canonical SMILES for 5-(3,5-dichlorophenyl)-4-pyridin-2-yl-1,2-oxazol-3-amine is Nc1noc(-c2cc(Cl)cc(Cl)c2)c1-c1ccccn1.
What is the InChIKey of 5-(3,5-dichlorophenyl)-4-pyridin-2-yl-1,2-oxazol-3-amine?
The InChIKey is OADBRMUSLODULB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9Cl2N3O/c15-9-5-8(6-10(16)7-9)13-12(14(17)19-20-13)11-3-1-2-4-18-11/h1-7H,(H2,17,19).
What are the key properties of 5-(3,5-dichlorophenyl)-4-pyridin-2-yl-1,2-oxazol-3-amine?
5-(3,5-dichlorophenyl)-4-pyridin-2-yl-1,2-oxazol-3-amine has a molecular weight of 306.15 g/mol, XLogP of 4.29, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3,5-dichlorophenyl)-4-pyridin-2-yl-1,2-oxazol-3-amine is sourced from PubChem (CID 80521472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).