6-[(2-methoxy-4-methylanilino)methyl]pyridin-3-ol

C14H16N2O2 — CID 79782889

IUPAC6-[(2-methoxy-4-methylanilino)methyl]pyridin-3-ol
SMILESCOc1cc(C)ccc1NCc1ccc(O)cn1
InChIInChI=1S/C14H16N2O2/c1-10-3-6-13(14(7-10)18-2)16-8-11-4-5-12(17)9-15-11/h3-7,9,16-17H,8H2,1-2H3
InChIKeyYIONEOPSSYNSBG-UHFFFAOYSA-N
MW244.29 g/mol
LogP2.72
Rot. Bonds4

About 6-[(2-methoxy-4-methylanilino)methyl]pyridin-3-ol

6-[(2-methoxy-4-methylanilino)methyl]pyridin-3-ol (PubChem CID 79782889) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is 6-[(2-methoxy-4-methylanilino)methyl]pyridin-3-ol.

Molecular Properties

Compound Name6-[(2-methoxy-4-methylanilino)methyl]pyridin-3-ol
PubChem CID79782889
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC Name6-[(2-methoxy-4-methylanilino)methyl]pyridin-3-ol
SMILESCOc1cc(C)ccc1NCc1ccc(O)cn1
InChIInChI=1S/C14H16N2O2/c1-10-3-6-13(14(7-10)18-2)16-8-11-4-5-12(17)9-15-11/h3-7,9,16-17H,8H2,1-2H3
InChIKeyYIONEOPSSYNSBG-UHFFFAOYSA-N
XLogP2.72
TPSA54.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 52.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-[(2-methoxy-4-methylanilino)methyl]pyridin-3-ol?
The IUPAC name of 6-[(2-methoxy-4-methylanilino)methyl]pyridin-3-ol (CID 79782889) is 6-[(2-methoxy-4-methylanilino)methyl]pyridin-3-ol.
What is the SMILES notation for 6-[(2-methoxy-4-methylanilino)methyl]pyridin-3-ol?
The canonical SMILES for 6-[(2-methoxy-4-methylanilino)methyl]pyridin-3-ol is COc1cc(C)ccc1NCc1ccc(O)cn1.
What is the InChIKey of 6-[(2-methoxy-4-methylanilino)methyl]pyridin-3-ol?
The InChIKey is YIONEOPSSYNSBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c1-10-3-6-13(14(7-10)18-2)16-8-11-4-5-12(17)9-15-11/h3-7,9,16-17H,8H2,1-2H3.
What are the key properties of 6-[(2-methoxy-4-methylanilino)methyl]pyridin-3-ol?
6-[(2-methoxy-4-methylanilino)methyl]pyridin-3-ol has a molecular weight of 244.29 g/mol, XLogP of 2.72, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2-methoxy-4-methylanilino)methyl]pyridin-3-ol is sourced from PubChem (CID 79782889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).