4-[6-amino-5-(4-hydroxyphenyl)-4-methyl-3-pyridinyl]phenol

C18H16N2O2 — CID 122531706

IUPAC4-[6-amino-5-(4-hydroxyphenyl)-4-methyl-3-pyridinyl]phenol
SMILESCc1c(-c2ccc(O)cc2)cnc(N)c1-c1ccc(O)cc1
InChIInChI=1S/C18H16N2O2/c1-11-16(12-2-6-14(21)7-3-12)10-20-18(19)17(11)13-4-8-15(22)9-5-13/h2-10,21-22H,1H3,(H2,19,20)
InChIKeyISRXNXQILVVUHS-UHFFFAOYSA-N
MW292.34 g/mol
LogP3.72
Rot. Bonds2

About 4-[6-amino-5-(4-hydroxyphenyl)-4-methyl-3-pyridinyl]phenol

4-[6-amino-5-(4-hydroxyphenyl)-4-methyl-3-pyridinyl]phenol (PubChem CID 122531706) has the molecular formula C18H16N2O2 and a molecular weight of 292.34 g/mol. Its IUPAC name is 4-[6-amino-5-(4-hydroxyphenyl)-4-methyl-3-pyridinyl]phenol.

Molecular Properties

Compound Name4-[6-amino-5-(4-hydroxyphenyl)-4-methyl-3-pyridinyl]phenol
PubChem CID122531706
Molecular FormulaC18H16N2O2
Molecular Weight292.34 g/mol
Exact Mass292.12
IUPAC Name4-[6-amino-5-(4-hydroxyphenyl)-4-methyl-3-pyridinyl]phenol
SMILESCc1c(-c2ccc(O)cc2)cnc(N)c1-c1ccc(O)cc1
InChIInChI=1S/C18H16N2O2/c1-11-16(12-2-6-14(21)7-3-12)10-20-18(19)17(11)13-4-8-15(22)9-5-13/h2-10,21-22H,1H3,(H2,19,20)
InChIKeyISRXNXQILVVUHS-UHFFFAOYSA-N
XLogP3.72
TPSA79.37 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 53.72
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 4-[6-amino-5-(4-hydroxyphenyl)-4-methyl-3-pyridinyl]phenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-[6-amino-5-(4-hydroxyphenyl)-4-methyl-3-pyridinyl]phenol?
The IUPAC name of 4-[6-amino-5-(4-hydroxyphenyl)-4-methyl-3-pyridinyl]phenol (CID 122531706) is 4-[6-amino-5-(4-hydroxyphenyl)-4-methyl-3-pyridinyl]phenol.
What is the SMILES notation for 4-[6-amino-5-(4-hydroxyphenyl)-4-methyl-3-pyridinyl]phenol?
The canonical SMILES for 4-[6-amino-5-(4-hydroxyphenyl)-4-methyl-3-pyridinyl]phenol is Cc1c(-c2ccc(O)cc2)cnc(N)c1-c1ccc(O)cc1.
What is the InChIKey of 4-[6-amino-5-(4-hydroxyphenyl)-4-methyl-3-pyridinyl]phenol?
The InChIKey is ISRXNXQILVVUHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O2/c1-11-16(12-2-6-14(21)7-3-12)10-20-18(19)17(11)13-4-8-15(22)9-5-13/h2-10,21-22H,1H3,(H2,19,20).
What are the key properties of 4-[6-amino-5-(4-hydroxyphenyl)-4-methyl-3-pyridinyl]phenol?
4-[6-amino-5-(4-hydroxyphenyl)-4-methyl-3-pyridinyl]phenol has a molecular weight of 292.34 g/mol, XLogP of 3.72, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[6-amino-5-(4-hydroxyphenyl)-4-methyl-3-pyridinyl]phenol is sourced from PubChem (CID 122531706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).