2-methoxy-N-methylaniline

C8H11NO — CID 2759579

IUPAC2-methoxy-N-methylaniline
SMILESCNc1ccccc1OC
InChIInChI=1S/C8H11NO/c1-9-7-5-3-4-6-8(7)10-2/h3-6,9H,1-2H3
InChIKeyKNZWULOUXYKBLH-UHFFFAOYSA-N
MW137.18 g/mol
LogP1.74
Rot. Bonds2

About 2-methoxy-N-methylaniline

2-methoxy-N-methylaniline (PubChem CID 2759579) has the molecular formula C8H11NO and a molecular weight of 137.18 g/mol. Its IUPAC name is 2-methoxy-N-methylaniline.

Molecular Properties

Compound Name2-methoxy-N-methylaniline
PubChem CID2759579
Molecular FormulaC8H11NO
Molecular Weight137.18 g/mol
Exact Mass137.08
IUPAC Name2-methoxy-N-methylaniline
SMILESCNc1ccccc1OC
InChIInChI=1S/C8H11NO/c1-9-7-5-3-4-6-8(7)10-2/h3-6,9H,1-2H3
InChIKeyKNZWULOUXYKBLH-UHFFFAOYSA-N
XLogP1.74
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.18
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-methylaniline?
The IUPAC name of 2-methoxy-N-methylaniline (CID 2759579) is 2-methoxy-N-methylaniline.
What is the SMILES notation for 2-methoxy-N-methylaniline?
The canonical SMILES for 2-methoxy-N-methylaniline is CNc1ccccc1OC.
What is the InChIKey of 2-methoxy-N-methylaniline?
The InChIKey is KNZWULOUXYKBLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO/c1-9-7-5-3-4-6-8(7)10-2/h3-6,9H,1-2H3.
What are the key properties of 2-methoxy-N-methylaniline?
2-methoxy-N-methylaniline has a molecular weight of 137.18 g/mol, XLogP of 1.74, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-methylaniline is sourced from PubChem (CID 2759579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).