2-[3-(2-methoxyethoxy)propylamino]-1-phenylethanol

C14H23NO3 — CID 103603620

IUPAC2-[3-(2-methoxyethoxy)propylamino]-1-phenylethanol
SMILESCOCCOCCCNCC(O)c1ccccc1
InChIInChI=1S/C14H23NO3/c1-17-10-11-18-9-5-8-15-12-14(16)13-6-3-2-4-7-13/h2-4,6-7,14-16H,5,8-12H2,1H3
InChIKeyYDGNMDKMSKRTFI-UHFFFAOYSA-N
MW253.34 g/mol
LogP1.36
Rot. Bonds10

About 2-[3-(2-methoxyethoxy)propylamino]-1-phenylethanol

2-[3-(2-methoxyethoxy)propylamino]-1-phenylethanol (PubChem CID 103603620) has the molecular formula C14H23NO3 and a molecular weight of 253.34 g/mol. Its IUPAC name is 2-[3-(2-methoxyethoxy)propylamino]-1-phenylethanol.

Molecular Properties

Compound Name2-[3-(2-methoxyethoxy)propylamino]-1-phenylethanol
PubChem CID103603620
Molecular FormulaC14H23NO3
Molecular Weight253.34 g/mol
Exact Mass253.17
IUPAC Name2-[3-(2-methoxyethoxy)propylamino]-1-phenylethanol
SMILESCOCCOCCCNCC(O)c1ccccc1
InChIInChI=1S/C14H23NO3/c1-17-10-11-18-9-5-8-15-12-14(16)13-6-3-2-4-7-13/h2-4,6-7,14-16H,5,8-12H2,1H3
InChIKeyYDGNMDKMSKRTFI-UHFFFAOYSA-N
XLogP1.36
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.34
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-[6-(3,3-diphenylpropoxy)hexylamino]-1-phenylethanol
CID 67818674
2-chloro-N-[3-(2-methoxyethoxy)propyl]-2-phenylacetamide
CID 61251247
3-(3-methoxypropylamino)-2-phenylpropanoic acid
CID 64565855
2-(3-methoxypropylamino)-1-naphthalen-2-ylethanol
CID 60900061
(2R)-2-amino-N-[3-(2-methoxyethoxy)propyl]-2-phenylacetamide
CID 61275798
(1S)-2-(hexylamino)-1-phenylethanol
CID 102581936
3-(2-methoxyethoxy)-N-(3-phenoxypropyl)propan-1-amine
CID 103605643
1-(2-methoxyethoxy)-3-(3-phenoxypropylamino)propan-2-ol
CID 106989841
N-[3-[(2-hydroxy-2-phenylethyl)amino]propyl]acetamide
CID 82312079
2-(3-ethoxypropylamino)-1-(4-propan-2-ylphenyl)ethanol
CID 60901286
2-(3-methoxypropylamino)-1-(4-propoxyphenyl)ethanol
CID 82314072
N-(2,2-diphenylethyl)-4-methoxybutan-1-amine
CID 103896916

Frequently Asked Questions

What is the IUPAC name of 2-[3-(2-methoxyethoxy)propylamino]-1-phenylethanol?
The IUPAC name of 2-[3-(2-methoxyethoxy)propylamino]-1-phenylethanol (CID 103603620) is 2-[3-(2-methoxyethoxy)propylamino]-1-phenylethanol.
What is the SMILES notation for 2-[3-(2-methoxyethoxy)propylamino]-1-phenylethanol?
The canonical SMILES for 2-[3-(2-methoxyethoxy)propylamino]-1-phenylethanol is COCCOCCCNCC(O)c1ccccc1.
What is the InChIKey of 2-[3-(2-methoxyethoxy)propylamino]-1-phenylethanol?
The InChIKey is YDGNMDKMSKRTFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO3/c1-17-10-11-18-9-5-8-15-12-14(16)13-6-3-2-4-7-13/h2-4,6-7,14-16H,5,8-12H2,1H3.
What are the key properties of 2-[3-(2-methoxyethoxy)propylamino]-1-phenylethanol?
2-[3-(2-methoxyethoxy)propylamino]-1-phenylethanol has a molecular weight of 253.34 g/mol, XLogP of 1.36, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(2-methoxyethoxy)propylamino]-1-phenylethanol is sourced from PubChem (CID 103603620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).