2-(ethylamino)-3-methoxy-1-phenylpropan-1-ol

C12H19NO2 — CID 23396953

IUPAC2-(ethylamino)-3-methoxy-1-phenylpropan-1-ol
SMILESCCNC(COC)C(O)c1ccccc1
InChIInChI=1S/C12H19NO2/c1-3-13-11(9-15-2)12(14)10-7-5-4-6-8-10/h4-8,11-14H,3,9H2,1-2H3
InChIKeyBJPNISNIUKBTDO-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.34
Rot. Bonds6

About 2-(ethylamino)-3-methoxy-1-phenylpropan-1-ol

2-(ethylamino)-3-methoxy-1-phenylpropan-1-ol (PubChem CID 23396953) has the molecular formula C12H19NO2 and a molecular weight of 209.29 g/mol. Its IUPAC name is 2-(ethylamino)-3-methoxy-1-phenylpropan-1-ol.

Molecular Properties

Compound Name2-(ethylamino)-3-methoxy-1-phenylpropan-1-ol
PubChem CID23396953
Molecular FormulaC12H19NO2
Molecular Weight209.29 g/mol
Exact Mass209.14
IUPAC Name2-(ethylamino)-3-methoxy-1-phenylpropan-1-ol
SMILESCCNC(COC)C(O)c1ccccc1
InChIInChI=1S/C12H19NO2/c1-3-13-11(9-15-2)12(14)10-7-5-4-6-8-10/h4-8,11-14H,3,9H2,1-2H3
InChIKeyBJPNISNIUKBTDO-UHFFFAOYSA-N
XLogP1.34
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-1-methoxy-2-phenylhexan-3-amine
CID 103466366
benzene;2-methoxy-1-phenylethanol
CID 174622919
(1R)-2-(chloromethyl)-3-methoxy-1-phenylpropan-1-ol
CID 140907423
N-ethyl-7-methoxy-2-phenylheptan-3-amine
CID 112754792
(1R)-3-[(1-methoxy-3-methylbutan-2-yl)amino]-1-phenylpropan-1-ol
CID 112742117
methyl 4-hydroxy-3-(3-methoxypropylamino)-4-phenylbutanoate
CID 82347295
N-(1-hydroxy-3-methoxy-1-phenylpropan-2-yl)-3,4-dimethoxybenzenesulfonamide
CID 6734824
(3-methoxy-1,1-diphenylpropan-2-yl)hydrazine
CID 105200297
2-(ethylamino)-1-(4-propan-2-ylphenyl)butan-1-ol
CID 82312822
1-methoxy-3-[[(1R)-1-phenylethyl]amino]propan-2-ol
CID 78953875
[[(1S,2S)-1-hydroxy-3-methoxy-1-phenylpropan-2-yl]-diphenylphosphaniumyl]boranuide
CID 139199421
2-[(2-methoxy-1-phenylethyl)amino]-1-phenylethanol
CID 103913587

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-3-methoxy-1-phenylpropan-1-ol?
The IUPAC name of 2-(ethylamino)-3-methoxy-1-phenylpropan-1-ol (CID 23396953) is 2-(ethylamino)-3-methoxy-1-phenylpropan-1-ol.
What is the SMILES notation for 2-(ethylamino)-3-methoxy-1-phenylpropan-1-ol?
The canonical SMILES for 2-(ethylamino)-3-methoxy-1-phenylpropan-1-ol is CCNC(COC)C(O)c1ccccc1.
What is the InChIKey of 2-(ethylamino)-3-methoxy-1-phenylpropan-1-ol?
The InChIKey is BJPNISNIUKBTDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO2/c1-3-13-11(9-15-2)12(14)10-7-5-4-6-8-10/h4-8,11-14H,3,9H2,1-2H3.
What are the key properties of 2-(ethylamino)-3-methoxy-1-phenylpropan-1-ol?
2-(ethylamino)-3-methoxy-1-phenylpropan-1-ol has a molecular weight of 209.29 g/mol, XLogP of 1.34, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-3-methoxy-1-phenylpropan-1-ol is sourced from PubChem (CID 23396953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).