[4-(1-aminopropan-2-yloxy)-3-methoxyphenyl]methanol

C11H17NO3 — CID 107742816

IUPAC[4-(1-aminopropan-2-yloxy)-3-methoxyphenyl]methanol
SMILESCOc1cc(CO)ccc1OC(C)CN
InChIInChI=1S/C11H17NO3/c1-8(6-12)15-10-4-3-9(7-13)5-11(10)14-2/h3-5,8,13H,6-7,12H2,1-2H3
InChIKeyLGKPELZTIOXLJR-UHFFFAOYSA-N
MW211.26 g/mol
LogP0.91
Rot. Bonds5

About [4-(1-aminopropan-2-yloxy)-3-methoxyphenyl]methanol

[4-(1-aminopropan-2-yloxy)-3-methoxyphenyl]methanol (PubChem CID 107742816) has the molecular formula C11H17NO3 and a molecular weight of 211.26 g/mol. Its IUPAC name is [4-(1-aminopropan-2-yloxy)-3-methoxyphenyl]methanol.

Molecular Properties

Compound Name[4-(1-aminopropan-2-yloxy)-3-methoxyphenyl]methanol
PubChem CID107742816
Molecular FormulaC11H17NO3
Molecular Weight211.26 g/mol
Exact Mass211.12
IUPAC Name[4-(1-aminopropan-2-yloxy)-3-methoxyphenyl]methanol
SMILESCOc1cc(CO)ccc1OC(C)CN
InChIInChI=1S/C11H17NO3/c1-8(6-12)15-10-4-3-9(7-13)5-11(10)14-2/h3-5,8,13H,6-7,12H2,1-2H3
InChIKeyLGKPELZTIOXLJR-UHFFFAOYSA-N
XLogP0.91
TPSA64.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 50.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze [4-(1-aminopropan-2-yloxy)-3-methoxyphenyl]methanol 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

(3-butan-2-yloxy-4-methoxyphenyl)methanol
CID 43209251
[4-[1-(4-aminophenyl)ethoxy]-3-methoxyphenyl]methanol
CID 107742769
[3-methoxy-4-(4-methylpentan-2-yloxy)phenyl]methanamine
CID 114284718
[4-[2-amino-1-(3-chlorophenyl)ethoxy]-3-methoxyphenyl]methanol
CID 107742711
[4-(2-amino-1-thiophen-3-ylethoxy)-3-methoxyphenyl]methanol
CID 107742689
(3-methoxy-4-phosphanyloxyphenyl)methanol
CID 89023367
[4-[[4-(aminomethyl)phenyl]methoxy]-3-methoxyphenyl]methanol
CID 107742818
N,N-diethyl-2-[4-(hydroxymethyl)-2-methoxyphenoxy]propanamide
CID 43115697
2-(2,5-dibromo-4-methoxyphenoxy)propan-1-amine
CID 79415829
1,2-dimethoxy-4-[2-(2-methoxyphenoxy)propyl]benzene
CID 57481807
[3-methoxy-4-[(2-methylpropan-2-yl)oxy]phenyl]methanol
CID 139947952
[5-(hydroxymethyl)-2-methoxyphenoxy]boronic acid
CID 142791148

Frequently Asked Questions

What is the IUPAC name of [4-(1-aminopropan-2-yloxy)-3-methoxyphenyl]methanol?
The IUPAC name of [4-(1-aminopropan-2-yloxy)-3-methoxyphenyl]methanol (CID 107742816) is [4-(1-aminopropan-2-yloxy)-3-methoxyphenyl]methanol.
What is the SMILES notation for [4-(1-aminopropan-2-yloxy)-3-methoxyphenyl]methanol?
The canonical SMILES for [4-(1-aminopropan-2-yloxy)-3-methoxyphenyl]methanol is COc1cc(CO)ccc1OC(C)CN.
What is the InChIKey of [4-(1-aminopropan-2-yloxy)-3-methoxyphenyl]methanol?
The InChIKey is LGKPELZTIOXLJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO3/c1-8(6-12)15-10-4-3-9(7-13)5-11(10)14-2/h3-5,8,13H,6-7,12H2,1-2H3.
What are the key properties of [4-(1-aminopropan-2-yloxy)-3-methoxyphenyl]methanol?
[4-(1-aminopropan-2-yloxy)-3-methoxyphenyl]methanol has a molecular weight of 211.26 g/mol, XLogP of 0.91, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(1-aminopropan-2-yloxy)-3-methoxyphenyl]methanol is sourced from PubChem (CID 107742816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).