2-(1-aminopropan-2-yl)-6-(methoxymethyl)phenol

C11H17NO2 — CID 83879383

IUPAC2-(1-aminopropan-2-yl)-6-(methoxymethyl)phenol
SMILESCOCc1cccc(C(C)CN)c1O
InChIInChI=1S/C11H17NO2/c1-8(6-12)10-5-3-4-9(7-14-2)11(10)13/h3-5,8,13H,6-7,12H2,1-2H3
InChIKeyMALMQSMRHLXKDC-UHFFFAOYSA-N
MW195.26 g/mol
LogP1.60
Rot. Bonds4

About 2-(1-aminopropan-2-yl)-6-(methoxymethyl)phenol

2-(1-aminopropan-2-yl)-6-(methoxymethyl)phenol (PubChem CID 83879383) has the molecular formula C11H17NO2 and a molecular weight of 195.26 g/mol. Its IUPAC name is 2-(1-aminopropan-2-yl)-6-(methoxymethyl)phenol.

Molecular Properties

Compound Name2-(1-aminopropan-2-yl)-6-(methoxymethyl)phenol
PubChem CID83879383
Molecular FormulaC11H17NO2
Molecular Weight195.26 g/mol
Exact Mass195.13
IUPAC Name2-(1-aminopropan-2-yl)-6-(methoxymethyl)phenol
SMILESCOCc1cccc(C(C)CN)c1O
InChIInChI=1S/C11H17NO2/c1-8(6-12)10-5-3-4-9(7-14-2)11(10)13/h3-5,8,13H,6-7,12H2,1-2H3
InChIKeyMALMQSMRHLXKDC-UHFFFAOYSA-N
XLogP1.60
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(1-aminopropan-2-yl)-6-(methoxymethyl)phenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[2-fluoro-3-(methoxymethyl)phenyl]propan-1-amine
CID 117287255
3-amino-2-[2-hydroxy-3-(methoxymethyl)phenyl]propanoic acid
CID 117323019
2-(1-aminopropan-2-yl)phenol
CID 3028046
2-(1-aminopropan-2-yl)-4-(methoxymethyl)phenol
CID 83879401
2-(4-aminobutan-2-yl)-6-ethylphenol
CID 117284201
3-[2-fluoro-3-(methoxymethyl)phenyl]butan-1-amine
CID 117302072
2-[3-(fluoromethyl)-2-methoxyphenyl]propan-1-amine
CID 84667736
[2,6-bis(methoxymethyl)phenyl]methanamine;hydrochloride
CID 19835696
1-[2-fluoro-3-(methoxymethyl)phenyl]ethanol
CID 117279865
2-(2-propan-2-ylphenyl)propan-1-amine
CID 82599641
3-amino-2-[2-fluoro-3-(methoxymethyl)phenyl]propanoic acid
CID 117326599
2-ethyl-6-(1-hydroxypropan-2-yl)phenol
CID 117278483

Frequently Asked Questions

What is the IUPAC name of 2-(1-aminopropan-2-yl)-6-(methoxymethyl)phenol?
The IUPAC name of 2-(1-aminopropan-2-yl)-6-(methoxymethyl)phenol (CID 83879383) is 2-(1-aminopropan-2-yl)-6-(methoxymethyl)phenol.
What is the SMILES notation for 2-(1-aminopropan-2-yl)-6-(methoxymethyl)phenol?
The canonical SMILES for 2-(1-aminopropan-2-yl)-6-(methoxymethyl)phenol is COCc1cccc(C(C)CN)c1O.
What is the InChIKey of 2-(1-aminopropan-2-yl)-6-(methoxymethyl)phenol?
The InChIKey is MALMQSMRHLXKDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2/c1-8(6-12)10-5-3-4-9(7-14-2)11(10)13/h3-5,8,13H,6-7,12H2,1-2H3.
What are the key properties of 2-(1-aminopropan-2-yl)-6-(methoxymethyl)phenol?
2-(1-aminopropan-2-yl)-6-(methoxymethyl)phenol has a molecular weight of 195.26 g/mol, XLogP of 1.60, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-aminopropan-2-yl)-6-(methoxymethyl)phenol is sourced from PubChem (CID 83879383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).