2-amino-5-[4-(1-methoxyethenyl)phenyl]pyridin-3-ol

C14H14N2O2 — CID 143190295

IUPAC2-amino-5-[4-(1-methoxyethenyl)phenyl]pyridin-3-ol
SMILESC=C(OC)c1ccc(-c2cnc(N)c(O)c2)cc1
InChIInChI=1S/C14H14N2O2/c1-9(18-2)10-3-5-11(6-4-10)12-7-13(17)14(15)16-8-12/h3-8,17H,1H2,2H3,(H2,15,16)
InChIKeyCZKUBGWAOUBQHH-UHFFFAOYSA-N
MW242.28 g/mol
LogP2.65
Rot. Bonds3

About 2-amino-5-[4-(1-methoxyethenyl)phenyl]pyridin-3-ol

2-amino-5-[4-(1-methoxyethenyl)phenyl]pyridin-3-ol (PubChem CID 143190295) has the molecular formula C14H14N2O2 and a molecular weight of 242.28 g/mol. Its IUPAC name is 2-amino-5-[4-(1-methoxyethenyl)phenyl]pyridin-3-ol.

Molecular Properties

Compound Name2-amino-5-[4-(1-methoxyethenyl)phenyl]pyridin-3-ol
PubChem CID143190295
Molecular FormulaC14H14N2O2
Molecular Weight242.28 g/mol
Exact Mass242.11
IUPAC Name2-amino-5-[4-(1-methoxyethenyl)phenyl]pyridin-3-ol
SMILESC=C(OC)c1ccc(-c2cnc(N)c(O)c2)cc1
InChIInChI=1S/C14H14N2O2/c1-9(18-2)10-3-5-11(6-4-10)12-7-13(17)14(15)16-8-12/h3-8,17H,1H2,2H3,(H2,15,16)
InChIKeyCZKUBGWAOUBQHH-UHFFFAOYSA-N
XLogP2.65
TPSA68.37 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-amino-5-[4-(1-methoxyethenyl)phenyl]pyridin-3-ol?
The IUPAC name of 2-amino-5-[4-(1-methoxyethenyl)phenyl]pyridin-3-ol (CID 143190295) is 2-amino-5-[4-(1-methoxyethenyl)phenyl]pyridin-3-ol.
What is the SMILES notation for 2-amino-5-[4-(1-methoxyethenyl)phenyl]pyridin-3-ol?
The canonical SMILES for 2-amino-5-[4-(1-methoxyethenyl)phenyl]pyridin-3-ol is C=C(OC)c1ccc(-c2cnc(N)c(O)c2)cc1.
What is the InChIKey of 2-amino-5-[4-(1-methoxyethenyl)phenyl]pyridin-3-ol?
The InChIKey is CZKUBGWAOUBQHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2/c1-9(18-2)10-3-5-11(6-4-10)12-7-13(17)14(15)16-8-12/h3-8,17H,1H2,2H3,(H2,15,16).
What are the key properties of 2-amino-5-[4-(1-methoxyethenyl)phenyl]pyridin-3-ol?
2-amino-5-[4-(1-methoxyethenyl)phenyl]pyridin-3-ol has a molecular weight of 242.28 g/mol, XLogP of 2.65, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-[4-(1-methoxyethenyl)phenyl]pyridin-3-ol is sourced from PubChem (CID 143190295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).