3-[6-methylidene-1-(3-methylphenyl)-3-pyridinyl]phenol

C19H17NO — CID 89134247

IUPAC3-[6-methylidene-1-(3-methylphenyl)-3-pyridinyl]phenol
SMILESC=C1C=CC(c2cccc(O)c2)=CN1c1cccc(C)c1
InChIInChI=1S/C19H17NO/c1-14-5-3-7-18(11-14)20-13-17(10-9-15(20)2)16-6-4-8-19(21)12-16/h3-13,21H,2H2,1H3
InChIKeyYMVLJMLEQJTYTL-UHFFFAOYSA-N
MW275.35 g/mol
LogP4.63
Rot. Bonds2

About 3-[6-methylidene-1-(3-methylphenyl)-3-pyridinyl]phenol

3-[6-methylidene-1-(3-methylphenyl)-3-pyridinyl]phenol (PubChem CID 89134247) has the molecular formula C19H17NO and a molecular weight of 275.35 g/mol. Its IUPAC name is 3-[6-methylidene-1-(3-methylphenyl)-3-pyridinyl]phenol.

Molecular Properties

Compound Name3-[6-methylidene-1-(3-methylphenyl)-3-pyridinyl]phenol
PubChem CID89134247
Molecular FormulaC19H17NO
Molecular Weight275.35 g/mol
Exact Mass275.13
IUPAC Name3-[6-methylidene-1-(3-methylphenyl)-3-pyridinyl]phenol
SMILESC=C1C=CC(c2cccc(O)c2)=CN1c1cccc(C)c1
InChIInChI=1S/C19H17NO/c1-14-5-3-7-18(11-14)20-13-17(10-9-15(20)2)16-6-4-8-19(21)12-16/h3-13,21H,2H2,1H3
InChIKeyYMVLJMLEQJTYTL-UHFFFAOYSA-N
XLogP4.63
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 54.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-[6-methylidene-1-(3-methylphenyl)-3-pyridinyl]phenol?
The IUPAC name of 3-[6-methylidene-1-(3-methylphenyl)-3-pyridinyl]phenol (CID 89134247) is 3-[6-methylidene-1-(3-methylphenyl)-3-pyridinyl]phenol.
What is the SMILES notation for 3-[6-methylidene-1-(3-methylphenyl)-3-pyridinyl]phenol?
The canonical SMILES for 3-[6-methylidene-1-(3-methylphenyl)-3-pyridinyl]phenol is C=C1C=CC(c2cccc(O)c2)=CN1c1cccc(C)c1.
What is the InChIKey of 3-[6-methylidene-1-(3-methylphenyl)-3-pyridinyl]phenol?
The InChIKey is YMVLJMLEQJTYTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17NO/c1-14-5-3-7-18(11-14)20-13-17(10-9-15(20)2)16-6-4-8-19(21)12-16/h3-13,21H,2H2,1H3.
What are the key properties of 3-[6-methylidene-1-(3-methylphenyl)-3-pyridinyl]phenol?
3-[6-methylidene-1-(3-methylphenyl)-3-pyridinyl]phenol has a molecular weight of 275.35 g/mol, XLogP of 4.63, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[6-methylidene-1-(3-methylphenyl)-3-pyridinyl]phenol is sourced from PubChem (CID 89134247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).