2-[2-(methylamino)propyl]phenol

C10H15NO — CID 11405

IUPAC2-[2-(methylamino)propyl]phenol
SMILESCNC(C)Cc1ccccc1O
InChIInChI=1S/C10H15NO/c1-8(11-2)7-9-5-3-4-6-10(9)12/h3-6,8,11-12H,7H2,1-2H3
InChIKeySAHBITMBCTXQOR-UHFFFAOYSA-N
MW165.24 g/mol
LogP1.54
Rot. Bonds3

About 2-[2-(methylamino)propyl]phenol

2-[2-(methylamino)propyl]phenol (PubChem CID 11405) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is 2-[2-(methylamino)propyl]phenol.

Molecular Properties

Compound Name2-[2-(methylamino)propyl]phenol
PubChem CID11405
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC Name2-[2-(methylamino)propyl]phenol
SMILESCNC(C)Cc1ccccc1O
InChIInChI=1S/C10H15NO/c1-8(11-2)7-9-5-3-4-6-10(9)12/h3-6,8,11-12H,7H2,1-2H3
InChIKeySAHBITMBCTXQOR-UHFFFAOYSA-N
XLogP1.54
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(methylamino)propyl]phenol?
The IUPAC name of 2-[2-(methylamino)propyl]phenol (CID 11405) is 2-[2-(methylamino)propyl]phenol.
What is the SMILES notation for 2-[2-(methylamino)propyl]phenol?
The canonical SMILES for 2-[2-(methylamino)propyl]phenol is CNC(C)Cc1ccccc1O.
What is the InChIKey of 2-[2-(methylamino)propyl]phenol?
The InChIKey is SAHBITMBCTXQOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO/c1-8(11-2)7-9-5-3-4-6-10(9)12/h3-6,8,11-12H,7H2,1-2H3.
What are the key properties of 2-[2-(methylamino)propyl]phenol?
2-[2-(methylamino)propyl]phenol has a molecular weight of 165.24 g/mol, XLogP of 1.54, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(methylamino)propyl]phenol is sourced from PubChem (CID 11405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).