1-(dimethylamino)-3-(2-methoxyphenyl)propan-2-ol

C12H19NO2 — CID 79088057

IUPAC1-(dimethylamino)-3-(2-methoxyphenyl)propan-2-ol
SMILESCOc1ccccc1CC(O)CN(C)C
InChIInChI=1S/C12H19NO2/c1-13(2)9-11(14)8-10-6-4-5-7-12(10)15-3/h4-7,11,14H,8-9H2,1-3H3
InChIKeyMSURJKDROBSUDV-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.16
Rot. Bonds5

About 1-(dimethylamino)-3-(2-methoxyphenyl)propan-2-ol

1-(dimethylamino)-3-(2-methoxyphenyl)propan-2-ol (PubChem CID 79088057) has the molecular formula C12H19NO2 and a molecular weight of 209.29 g/mol. Its IUPAC name is 1-(dimethylamino)-3-(2-methoxyphenyl)propan-2-ol.

Molecular Properties

Compound Name1-(dimethylamino)-3-(2-methoxyphenyl)propan-2-ol
PubChem CID79088057
Molecular FormulaC12H19NO2
Molecular Weight209.29 g/mol
Exact Mass209.14
IUPAC Name1-(dimethylamino)-3-(2-methoxyphenyl)propan-2-ol
SMILESCOc1ccccc1CC(O)CN(C)C
InChIInChI=1S/C12H19NO2/c1-13(2)9-11(14)8-10-6-4-5-7-12(10)15-3/h4-7,11,14H,8-9H2,1-3H3
InChIKeyMSURJKDROBSUDV-UHFFFAOYSA-N
XLogP1.16
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(dimethylamino)-3-(2-methylphenyl)propan-2-ol
CID 79087104
(2R)-1-(2-methoxyphenyl)propan-2-ol
CID 6951555
1-(2-methoxyphenyl)-4,4-dimethylpentan-2-ol
CID 63018076
1-(2-chlorophenyl)-3-(2-methoxyphenyl)propan-2-ol
CID 61261227
1-(2-methoxyphenyl)-3-(methylamino)propan-2-ol
CID 64983172
1-(2-fluorophenyl)-3-(2-methoxyphenyl)propan-2-ol
CID 61263658
1-(2-methoxyphenyl)hexan-2-ol
CID 62607835
(2R)-4,4,4-trifluoro-1-(2-methoxyphenyl)butan-2-ol;4,4,4-trifluoro-1-(2-methoxyphenyl)butan-2-ol
CID 158657667
1-(dimethylamino)-3-naphthalen-1-ylpropan-2-ol
CID 79088048
1-(2-methoxyphenyl)-3-phenylsulfanylpropan-2-ol
CID 65142108
1-(2,6-dimethoxyphenyl)-2-(2-methoxyphenyl)ethanol
CID 63018829
1-(5-chloro-2-methoxyphenyl)-3-(2-methoxyphenyl)propan-2-ol
CID 62608604

Frequently Asked Questions

What is the IUPAC name of 1-(dimethylamino)-3-(2-methoxyphenyl)propan-2-ol?
The IUPAC name of 1-(dimethylamino)-3-(2-methoxyphenyl)propan-2-ol (CID 79088057) is 1-(dimethylamino)-3-(2-methoxyphenyl)propan-2-ol.
What is the SMILES notation for 1-(dimethylamino)-3-(2-methoxyphenyl)propan-2-ol?
The canonical SMILES for 1-(dimethylamino)-3-(2-methoxyphenyl)propan-2-ol is COc1ccccc1CC(O)CN(C)C.
What is the InChIKey of 1-(dimethylamino)-3-(2-methoxyphenyl)propan-2-ol?
The InChIKey is MSURJKDROBSUDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO2/c1-13(2)9-11(14)8-10-6-4-5-7-12(10)15-3/h4-7,11,14H,8-9H2,1-3H3.
What are the key properties of 1-(dimethylamino)-3-(2-methoxyphenyl)propan-2-ol?
1-(dimethylamino)-3-(2-methoxyphenyl)propan-2-ol has a molecular weight of 209.29 g/mol, XLogP of 1.16, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(dimethylamino)-3-(2-methoxyphenyl)propan-2-ol is sourced from PubChem (CID 79088057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).