2-benzyl-4-[3-(methylamino)phenyl]pyridin-3-ol

C19H18N2O — CID 57150377

IUPAC2-benzyl-4-[3-(methylamino)phenyl]pyridin-3-ol
SMILESCNc1cccc(-c2ccnc(Cc3ccccc3)c2O)c1
InChIInChI=1S/C19H18N2O/c1-20-16-9-5-8-15(13-16)17-10-11-21-18(19(17)22)12-14-6-3-2-4-7-14/h2-11,13,20,22H,12H2,1H3
InChIKeyBVTJEICWUAJHFY-UHFFFAOYSA-N
MW290.37 g/mol
LogP4.09
Rot. Bonds4

About 2-benzyl-4-[3-(methylamino)phenyl]pyridin-3-ol

2-benzyl-4-[3-(methylamino)phenyl]pyridin-3-ol (PubChem CID 57150377) has the molecular formula C19H18N2O and a molecular weight of 290.37 g/mol. Its IUPAC name is 2-benzyl-4-[3-(methylamino)phenyl]pyridin-3-ol.

Molecular Properties

Compound Name2-benzyl-4-[3-(methylamino)phenyl]pyridin-3-ol
PubChem CID57150377
Molecular FormulaC19H18N2O
Molecular Weight290.37 g/mol
Exact Mass290.14
IUPAC Name2-benzyl-4-[3-(methylamino)phenyl]pyridin-3-ol
SMILESCNc1cccc(-c2ccnc(Cc3ccccc3)c2O)c1
InChIInChI=1S/C19H18N2O/c1-20-16-9-5-8-15(13-16)17-10-11-21-18(19(17)22)12-14-6-3-2-4-7-14/h2-11,13,20,22H,12H2,1H3
InChIKeyBVTJEICWUAJHFY-UHFFFAOYSA-N
XLogP4.09
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 54.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-benzyl-4-[3-(methylamino)phenyl]pyridin-3-ol?
The IUPAC name of 2-benzyl-4-[3-(methylamino)phenyl]pyridin-3-ol (CID 57150377) is 2-benzyl-4-[3-(methylamino)phenyl]pyridin-3-ol.
What is the SMILES notation for 2-benzyl-4-[3-(methylamino)phenyl]pyridin-3-ol?
The canonical SMILES for 2-benzyl-4-[3-(methylamino)phenyl]pyridin-3-ol is CNc1cccc(-c2ccnc(Cc3ccccc3)c2O)c1.
What is the InChIKey of 2-benzyl-4-[3-(methylamino)phenyl]pyridin-3-ol?
The InChIKey is BVTJEICWUAJHFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O/c1-20-16-9-5-8-15(13-16)17-10-11-21-18(19(17)22)12-14-6-3-2-4-7-14/h2-11,13,20,22H,12H2,1H3.
What are the key properties of 2-benzyl-4-[3-(methylamino)phenyl]pyridin-3-ol?
2-benzyl-4-[3-(methylamino)phenyl]pyridin-3-ol has a molecular weight of 290.37 g/mol, XLogP of 4.09, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzyl-4-[3-(methylamino)phenyl]pyridin-3-ol is sourced from PubChem (CID 57150377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).