2-(methylamino)-3-(4-phenylphenoxy)propan-1-ol

C16H19NO2 — CID 64809575

IUPAC2-(methylamino)-3-(4-phenylphenoxy)propan-1-ol
SMILESCNC(CO)COc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C16H19NO2/c1-17-15(11-18)12-19-16-9-7-14(8-10-16)13-5-3-2-4-6-13/h2-10,15,17-18H,11-12H2,1H3
InChIKeyARZFMZXMFWRVSL-UHFFFAOYSA-N
MW257.33 g/mol
LogP2.31
Rot. Bonds6

About 2-(methylamino)-3-(4-phenylphenoxy)propan-1-ol

2-(methylamino)-3-(4-phenylphenoxy)propan-1-ol (PubChem CID 64809575) has the molecular formula C16H19NO2 and a molecular weight of 257.33 g/mol. Its IUPAC name is 2-(methylamino)-3-(4-phenylphenoxy)propan-1-ol.

Molecular Properties

Compound Name2-(methylamino)-3-(4-phenylphenoxy)propan-1-ol
PubChem CID64809575
Molecular FormulaC16H19NO2
Molecular Weight257.33 g/mol
Exact Mass257.14
IUPAC Name2-(methylamino)-3-(4-phenylphenoxy)propan-1-ol
SMILESCNC(CO)COc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C16H19NO2/c1-17-15(11-18)12-19-16-9-7-14(8-10-16)13-5-3-2-4-6-13/h2-10,15,17-18H,11-12H2,1H3
InChIKeyARZFMZXMFWRVSL-UHFFFAOYSA-N
XLogP2.31
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.33
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(methylamino)-3-(4-phenylphenoxy)propan-1-ol 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-[4-(hydroxymethyl)phenoxy]-2-(methylamino)propan-1-ol
CID 64810173
3-[4-(2-methoxyethyl)phenoxy]-2-(methylamino)propan-1-ol
CID 64807086
3-(3-tert-butylphenoxy)-2-(methylamino)propan-1-ol
CID 64806251
(4-phenylphenoxy)methanol
CID 71028246
[(2S)-2-hydroxy-3-(4-phenylphenoxy)propyl]-trimethylazanium
CID 51859248
1-ethoxy-N-methyl-3-phenoxypropan-2-amine
CID 79574032
N-methyl-1-(4-phenoxyphenoxy)pentan-2-amine
CID 63474716
2-(methylamino)-3-(2-propan-2-ylphenoxy)propan-1-ol
CID 64804789
N-methyl-1-phenoxynonan-2-amine
CID 63416660
1-(4-chlorophenoxy)-N-methyl-3-phenylpropan-2-amine
CID 105084979
3-[3-(methoxymethyl)phenoxy]-2-(methylamino)propan-1-ol
CID 64809319
(2S)-3-methyl-1-(4-phenylphenoxy)butan-2-amine
CID 39109994

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-3-(4-phenylphenoxy)propan-1-ol?
The IUPAC name of 2-(methylamino)-3-(4-phenylphenoxy)propan-1-ol (CID 64809575) is 2-(methylamino)-3-(4-phenylphenoxy)propan-1-ol.
What is the SMILES notation for 2-(methylamino)-3-(4-phenylphenoxy)propan-1-ol?
The canonical SMILES for 2-(methylamino)-3-(4-phenylphenoxy)propan-1-ol is CNC(CO)COc1ccc(-c2ccccc2)cc1.
What is the InChIKey of 2-(methylamino)-3-(4-phenylphenoxy)propan-1-ol?
The InChIKey is ARZFMZXMFWRVSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO2/c1-17-15(11-18)12-19-16-9-7-14(8-10-16)13-5-3-2-4-6-13/h2-10,15,17-18H,11-12H2,1H3.
What are the key properties of 2-(methylamino)-3-(4-phenylphenoxy)propan-1-ol?
2-(methylamino)-3-(4-phenylphenoxy)propan-1-ol has a molecular weight of 257.33 g/mol, XLogP of 2.31, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-3-(4-phenylphenoxy)propan-1-ol is sourced from PubChem (CID 64809575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).