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

C12H19NO2 — CID 69429374

IUPAC3-(dimethylamino)-1-(2-methoxyphenyl)propan-1-ol
SMILESCOc1ccccc1C(O)CCN(C)C
InChIInChI=1S/C12H19NO2/c1-13(2)9-8-11(14)10-6-4-5-7-12(10)15-3/h4-7,11,14H,8-9H2,1-3H3
InChIKeyCGGCFJAOQIJQSF-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.68
Rot. Bonds5

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

3-(dimethylamino)-1-(2-methoxyphenyl)propan-1-ol (PubChem CID 69429374) has the molecular formula C12H19NO2 and a molecular weight of 209.29 g/mol. Its IUPAC name is 3-(dimethylamino)-1-(2-methoxyphenyl)propan-1-ol.

Molecular Properties

Compound Name3-(dimethylamino)-1-(2-methoxyphenyl)propan-1-ol
PubChem CID69429374
Molecular FormulaC12H19NO2
Molecular Weight209.29 g/mol
Exact Mass209.14
IUPAC Name3-(dimethylamino)-1-(2-methoxyphenyl)propan-1-ol
SMILESCOc1ccccc1C(O)CCN(C)C
InChIInChI=1S/C12H19NO2/c1-13(2)9-8-11(14)10-6-4-5-7-12(10)15-3/h4-7,11,14H,8-9H2,1-3H3
InChIKeyCGGCFJAOQIJQSF-UHFFFAOYSA-N
XLogP1.68
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 ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2,6-dimethoxyphenyl)-3-(dimethylamino)propan-1-ol
CID 116810226
3-chloro-1-(2-methoxyphenyl)propan-1-ol
CID 22621589
(1R)-4-chloro-1-(2-methoxyphenyl)butan-1-ol
CID 94256955
3-(dimethylamino)-1-(2-fluorophenyl)propan-1-ol
CID 62645456
4-(dimethylamino)-1-[2-(2-fluorophenoxy)phenyl]butan-1-ol
CID 12920935
3-ethoxy-1-(2-methoxyphenyl)propan-1-ol
CID 112688199
2-bromo-1-(2-methoxyphenyl)ethanol
CID 53441093
2-amino-1-(2-methoxyphenyl)ethanol;hydrochloride
CID 54593518
4-ethylsulfonyl-1-(2-methoxyphenyl)butan-1-ol
CID 65097851
1-(2-methoxyphenyl)-2-(methylamino)ethanol
CID 14888491
2-[2-(dimethylamino)ethyl-methylamino]-1-(2-ethoxyphenyl)ethanol
CID 55228321
1-[2-(2-methoxy-N-methylanilino)phenyl]propan-1-ol
CID 115995973

Frequently Asked Questions

What is the IUPAC name of 3-(dimethylamino)-1-(2-methoxyphenyl)propan-1-ol?
The IUPAC name of 3-(dimethylamino)-1-(2-methoxyphenyl)propan-1-ol (CID 69429374) is 3-(dimethylamino)-1-(2-methoxyphenyl)propan-1-ol.
What is the SMILES notation for 3-(dimethylamino)-1-(2-methoxyphenyl)propan-1-ol?
The canonical SMILES for 3-(dimethylamino)-1-(2-methoxyphenyl)propan-1-ol is COc1ccccc1C(O)CCN(C)C.
What is the InChIKey of 3-(dimethylamino)-1-(2-methoxyphenyl)propan-1-ol?
The InChIKey is CGGCFJAOQIJQSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO2/c1-13(2)9-8-11(14)10-6-4-5-7-12(10)15-3/h4-7,11,14H,8-9H2,1-3H3.
What are the key properties of 3-(dimethylamino)-1-(2-methoxyphenyl)propan-1-ol?
3-(dimethylamino)-1-(2-methoxyphenyl)propan-1-ol has a molecular weight of 209.29 g/mol, XLogP of 1.68, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylamino)-1-(2-methoxyphenyl)propan-1-ol is sourced from PubChem (CID 69429374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).