[4-(2-amino-5-methoxy-6-methyl-3-pyridinyl)phenyl]methanol

C14H16N2O2 — CID 157013064

IUPAC[4-(2-amino-5-methoxy-6-methyl-3-pyridinyl)phenyl]methanol
SMILESCOc1cc(-c2ccc(CO)cc2)c(N)nc1C
InChIInChI=1S/C14H16N2O2/c1-9-13(18-2)7-12(14(15)16-9)11-5-3-10(8-17)4-6-11/h3-7,17H,8H2,1-2H3,(H2,15,16)
InChIKeyNGXLJVNOGVSWRD-UHFFFAOYSA-N
MW244.29 g/mol
LogP2.14
Rot. Bonds3

About [4-(2-amino-5-methoxy-6-methyl-3-pyridinyl)phenyl]methanol

[4-(2-amino-5-methoxy-6-methyl-3-pyridinyl)phenyl]methanol (PubChem CID 157013064) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is [4-(2-amino-5-methoxy-6-methyl-3-pyridinyl)phenyl]methanol.

Molecular Properties

Compound Name[4-(2-amino-5-methoxy-6-methyl-3-pyridinyl)phenyl]methanol
PubChem CID157013064
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC Name[4-(2-amino-5-methoxy-6-methyl-3-pyridinyl)phenyl]methanol
SMILESCOc1cc(-c2ccc(CO)cc2)c(N)nc1C
InChIInChI=1S/C14H16N2O2/c1-9-13(18-2)7-12(14(15)16-9)11-5-3-10(8-17)4-6-11/h3-7,17H,8H2,1-2H3,(H2,15,16)
InChIKeyNGXLJVNOGVSWRD-UHFFFAOYSA-N
XLogP2.14
TPSA68.37 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [4-(2-amino-5-methoxy-6-methyl-3-pyridinyl)phenyl]methanol?
The IUPAC name of [4-(2-amino-5-methoxy-6-methyl-3-pyridinyl)phenyl]methanol (CID 157013064) is [4-(2-amino-5-methoxy-6-methyl-3-pyridinyl)phenyl]methanol.
What is the SMILES notation for [4-(2-amino-5-methoxy-6-methyl-3-pyridinyl)phenyl]methanol?
The canonical SMILES for [4-(2-amino-5-methoxy-6-methyl-3-pyridinyl)phenyl]methanol is COc1cc(-c2ccc(CO)cc2)c(N)nc1C.
What is the InChIKey of [4-(2-amino-5-methoxy-6-methyl-3-pyridinyl)phenyl]methanol?
The InChIKey is NGXLJVNOGVSWRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c1-9-13(18-2)7-12(14(15)16-9)11-5-3-10(8-17)4-6-11/h3-7,17H,8H2,1-2H3,(H2,15,16).
What are the key properties of [4-(2-amino-5-methoxy-6-methyl-3-pyridinyl)phenyl]methanol?
[4-(2-amino-5-methoxy-6-methyl-3-pyridinyl)phenyl]methanol has a molecular weight of 244.29 g/mol, XLogP of 2.14, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-amino-5-methoxy-6-methyl-3-pyridinyl)phenyl]methanol is sourced from PubChem (CID 157013064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).