[3-(2-aminopropyl)-2-methoxyphenyl]methanol

C11H17NO2 — CID 117285472

IUPAC[3-(2-aminopropyl)-2-methoxyphenyl]methanol
SMILESCOc1c(CO)cccc1CC(C)N
InChIInChI=1S/C11H17NO2/c1-8(12)6-9-4-3-5-10(7-13)11(9)14-2/h3-5,8,13H,6-7,12H2,1-2H3
InChIKeyOOEWRDYAPKRDLE-UHFFFAOYSA-N
MW195.26 g/mol
LogP1.08
Rot. Bonds4

About [3-(2-aminopropyl)-2-methoxyphenyl]methanol

[3-(2-aminopropyl)-2-methoxyphenyl]methanol (PubChem CID 117285472) has the molecular formula C11H17NO2 and a molecular weight of 195.26 g/mol. Its IUPAC name is [3-(2-aminopropyl)-2-methoxyphenyl]methanol.

Molecular Properties

Compound Name[3-(2-aminopropyl)-2-methoxyphenyl]methanol
PubChem CID117285472
Molecular FormulaC11H17NO2
Molecular Weight195.26 g/mol
Exact Mass195.13
IUPAC Name[3-(2-aminopropyl)-2-methoxyphenyl]methanol
SMILESCOc1c(CO)cccc1CC(C)N
InChIInChI=1S/C11H17NO2/c1-8(12)6-9-4-3-5-10(7-13)11(9)14-2/h3-5,8,13H,6-7,12H2,1-2H3
InChIKeyOOEWRDYAPKRDLE-UHFFFAOYSA-N
XLogP1.08
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 ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-methoxy-3-methylphenyl)propan-2-amine
CID 3029797
1-(2-methoxy-3-methylsulfanylphenyl)propan-2-amine
CID 117302169
[2-[(2S)-2-aminopropyl]phenyl]methanol
CID 130643067
2-[2-(2-aminopropyl)-6-methoxyphenoxy]acetamide
CID 54929037
(3-chloro-2-methoxyphenyl)methanol
CID 54184130
1-[3-methoxy-2-(2-methoxyethoxy)phenyl]propan-2-amine
CID 60907501
2-amino-3-(2,3-dimethoxyphenyl)propan-1-ol
CID 82394614
1-(2-methoxyphenyl)propan-2-amine;hydrochloride
CID 3029810
1-[3-methoxy-2-(3-methylbutoxy)phenyl]propan-2-amine
CID 60907892
1-(3-methoxy-2-propan-2-ylphenyl)propan-2-amine
CID 117296824
1-(4-chloro-1-methoxynaphthalen-2-yl)propan-2-amine
CID 170891521
1-[3-methoxy-2-(2-propan-2-yloxyethoxy)phenyl]propan-2-amine
CID 61483304

Frequently Asked Questions

What is the IUPAC name of [3-(2-aminopropyl)-2-methoxyphenyl]methanol?
The IUPAC name of [3-(2-aminopropyl)-2-methoxyphenyl]methanol (CID 117285472) is [3-(2-aminopropyl)-2-methoxyphenyl]methanol.
What is the SMILES notation for [3-(2-aminopropyl)-2-methoxyphenyl]methanol?
The canonical SMILES for [3-(2-aminopropyl)-2-methoxyphenyl]methanol is COc1c(CO)cccc1CC(C)N.
What is the InChIKey of [3-(2-aminopropyl)-2-methoxyphenyl]methanol?
The InChIKey is OOEWRDYAPKRDLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2/c1-8(12)6-9-4-3-5-10(7-13)11(9)14-2/h3-5,8,13H,6-7,12H2,1-2H3.
What are the key properties of [3-(2-aminopropyl)-2-methoxyphenyl]methanol?
[3-(2-aminopropyl)-2-methoxyphenyl]methanol has a molecular weight of 195.26 g/mol, XLogP of 1.08, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2-aminopropyl)-2-methoxyphenyl]methanol is sourced from PubChem (CID 117285472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).