4-[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]pyridin-2-amine

C15H13N3O2 — CID 71401542

IUPAC4-[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]pyridin-2-amine
SMILESCOc1ccc(-c2cnc(-c3ccnc(N)c3)o2)cc1
InChIInChI=1S/C15H13N3O2/c1-19-12-4-2-10(3-5-12)13-9-18-15(20-13)11-6-7-17-14(16)8-11/h2-9H,1H3,(H2,16,17)
InChIKeyITYCXFPDQMVLBS-UHFFFAOYSA-N
MW267.29 g/mol
LogP2.99
Rot. Bonds3

About 4-[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]pyridin-2-amine

4-[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]pyridin-2-amine (PubChem CID 71401542) has the molecular formula C15H13N3O2 and a molecular weight of 267.29 g/mol. Its IUPAC name is 4-[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]pyridin-2-amine.

Molecular Properties

Compound Name4-[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]pyridin-2-amine
PubChem CID71401542
Molecular FormulaC15H13N3O2
Molecular Weight267.29 g/mol
Exact Mass267.10
IUPAC Name4-[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]pyridin-2-amine
SMILESCOc1ccc(-c2cnc(-c3ccnc(N)c3)o2)cc1
InChIInChI=1S/C15H13N3O2/c1-19-12-4-2-10(3-5-12)13-9-18-15(20-13)11-6-7-17-14(16)8-11/h2-9H,1H3,(H2,16,17)
InChIKeyITYCXFPDQMVLBS-UHFFFAOYSA-N
XLogP2.99
TPSA74.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]pyridin-2-amine?
The IUPAC name of 4-[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]pyridin-2-amine (CID 71401542) is 4-[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]pyridin-2-amine.
What is the SMILES notation for 4-[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]pyridin-2-amine?
The canonical SMILES for 4-[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]pyridin-2-amine is COc1ccc(-c2cnc(-c3ccnc(N)c3)o2)cc1.
What is the InChIKey of 4-[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]pyridin-2-amine?
The InChIKey is ITYCXFPDQMVLBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O2/c1-19-12-4-2-10(3-5-12)13-9-18-15(20-13)11-6-7-17-14(16)8-11/h2-9H,1H3,(H2,16,17).
What are the key properties of 4-[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]pyridin-2-amine?
4-[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]pyridin-2-amine has a molecular weight of 267.29 g/mol, XLogP of 2.99, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]pyridin-2-amine is sourced from PubChem (CID 71401542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).