3-(methylamino)phenol

C7H9NO — CID 10820513

IUPAC3-(methylamino)phenol
SMILESCNc1cccc(O)c1
InChIInChI=1S/C7H9NO/c1-8-6-3-2-4-7(9)5-6/h2-5,8-9H,1H3
InChIKeyKLLOEOPUXBJSOW-UHFFFAOYSA-N
MW123.15 g/mol
LogP1.43
Rot. Bonds1

About 3-(methylamino)phenol

3-(methylamino)phenol (PubChem CID 10820513) has the molecular formula C7H9NO and a molecular weight of 123.15 g/mol. Its IUPAC name is 3-(methylamino)phenol.

Molecular Properties

Compound Name3-(methylamino)phenol
PubChem CID10820513
Molecular FormulaC7H9NO
Molecular Weight123.15 g/mol
Exact Mass123.07
IUPAC Name3-(methylamino)phenol
SMILESCNc1cccc(O)c1
InChIInChI=1S/C7H9NO/c1-8-6-3-2-4-7(9)5-6/h2-5,8-9H,1H3
InChIKeyKLLOEOPUXBJSOW-UHFFFAOYSA-N
XLogP1.43
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500123.15
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(methylamino)phenol?
The IUPAC name of 3-(methylamino)phenol (CID 10820513) is 3-(methylamino)phenol.
What is the SMILES notation for 3-(methylamino)phenol?
The canonical SMILES for 3-(methylamino)phenol is CNc1cccc(O)c1.
What is the InChIKey of 3-(methylamino)phenol?
The InChIKey is KLLOEOPUXBJSOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9NO/c1-8-6-3-2-4-7(9)5-6/h2-5,8-9H,1H3.
What are the key properties of 3-(methylamino)phenol?
3-(methylamino)phenol has a molecular weight of 123.15 g/mol, XLogP of 1.43, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methylamino)phenol is sourced from PubChem (CID 10820513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).