6-methoxy-N-[(5-methoxy-1,3-dimethylpyrazol-4-yl)methyl]-2-methylpyridin-3-amine

C14H20N4O2 — CID 86791062

IUPAC6-methoxy-N-[(5-methoxy-1,3-dimethylpyrazol-4-yl)methyl]-2-methylpyridin-3-amine
SMILESCOc1ccc(NCc2c(C)nn(C)c2OC)c(C)n1
InChIInChI=1S/C14H20N4O2/c1-9-11(14(20-5)18(3)17-9)8-15-12-6-7-13(19-4)16-10(12)2/h6-7,15H,8H2,1-5H3
InChIKeyHBKSOKZKSFLDHT-UHFFFAOYSA-N
MW276.34 g/mol
LogP2.06
Rot. Bonds5

About 6-methoxy-N-[(5-methoxy-1,3-dimethylpyrazol-4-yl)methyl]-2-methylpyridin-3-amine

6-methoxy-N-[(5-methoxy-1,3-dimethylpyrazol-4-yl)methyl]-2-methylpyridin-3-amine (PubChem CID 86791062) has the molecular formula C14H20N4O2 and a molecular weight of 276.34 g/mol. Its IUPAC name is 6-methoxy-N-[(5-methoxy-1,3-dimethylpyrazol-4-yl)methyl]-2-methylpyridin-3-amine.

Molecular Properties

Compound Name6-methoxy-N-[(5-methoxy-1,3-dimethylpyrazol-4-yl)methyl]-2-methylpyridin-3-amine
PubChem CID86791062
Molecular FormulaC14H20N4O2
Molecular Weight276.34 g/mol
Exact Mass276.16
IUPAC Name6-methoxy-N-[(5-methoxy-1,3-dimethylpyrazol-4-yl)methyl]-2-methylpyridin-3-amine
SMILESCOc1ccc(NCc2c(C)nn(C)c2OC)c(C)n1
InChIInChI=1S/C14H20N4O2/c1-9-11(14(20-5)18(3)17-9)8-15-12-6-7-13(19-4)16-10(12)2/h6-7,15H,8H2,1-5H3
InChIKeyHBKSOKZKSFLDHT-UHFFFAOYSA-N
XLogP2.06
TPSA61.20 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-methoxy-N-[(5-methoxy-1,3-dimethylpyrazol-4-yl)methyl]-2-methylpyridin-3-amine?
The IUPAC name of 6-methoxy-N-[(5-methoxy-1,3-dimethylpyrazol-4-yl)methyl]-2-methylpyridin-3-amine (CID 86791062) is 6-methoxy-N-[(5-methoxy-1,3-dimethylpyrazol-4-yl)methyl]-2-methylpyridin-3-amine.
What is the SMILES notation for 6-methoxy-N-[(5-methoxy-1,3-dimethylpyrazol-4-yl)methyl]-2-methylpyridin-3-amine?
The canonical SMILES for 6-methoxy-N-[(5-methoxy-1,3-dimethylpyrazol-4-yl)methyl]-2-methylpyridin-3-amine is COc1ccc(NCc2c(C)nn(C)c2OC)c(C)n1.
What is the InChIKey of 6-methoxy-N-[(5-methoxy-1,3-dimethylpyrazol-4-yl)methyl]-2-methylpyridin-3-amine?
The InChIKey is HBKSOKZKSFLDHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O2/c1-9-11(14(20-5)18(3)17-9)8-15-12-6-7-13(19-4)16-10(12)2/h6-7,15H,8H2,1-5H3.
What are the key properties of 6-methoxy-N-[(5-methoxy-1,3-dimethylpyrazol-4-yl)methyl]-2-methylpyridin-3-amine?
6-methoxy-N-[(5-methoxy-1,3-dimethylpyrazol-4-yl)methyl]-2-methylpyridin-3-amine has a molecular weight of 276.34 g/mol, XLogP of 2.06, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N-[(5-methoxy-1,3-dimethylpyrazol-4-yl)methyl]-2-methylpyridin-3-amine is sourced from PubChem (CID 86791062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).