3-(2-methoxyethoxy)-N-(3-phenoxypropyl)propan-1-amine

C15H25NO3 — CID 103605643

IUPAC3-(2-methoxyethoxy)-N-(3-phenoxypropyl)propan-1-amine
SMILESCOCCOCCCNCCCOc1ccccc1
InChIInChI=1S/C15H25NO3/c1-17-13-14-18-11-5-9-16-10-6-12-19-15-7-3-2-4-8-15/h2-4,7-8,16H,5-6,9-14H2,1H3
InChIKeySLEKPSZLLBTGGK-UHFFFAOYSA-N
MW267.37 g/mol
LogP2.10
Rot. Bonds12

About 3-(2-methoxyethoxy)-N-(3-phenoxypropyl)propan-1-amine

3-(2-methoxyethoxy)-N-(3-phenoxypropyl)propan-1-amine (PubChem CID 103605643) has the molecular formula C15H25NO3 and a molecular weight of 267.37 g/mol. Its IUPAC name is 3-(2-methoxyethoxy)-N-(3-phenoxypropyl)propan-1-amine.

Molecular Properties

Compound Name3-(2-methoxyethoxy)-N-(3-phenoxypropyl)propan-1-amine
PubChem CID103605643
Molecular FormulaC15H25NO3
Molecular Weight267.37 g/mol
Exact Mass267.18
IUPAC Name3-(2-methoxyethoxy)-N-(3-phenoxypropyl)propan-1-amine
SMILESCOCCOCCCNCCCOc1ccccc1
InChIInChI=1S/C15H25NO3/c1-17-13-14-18-11-5-9-16-10-6-12-19-15-7-3-2-4-8-15/h2-4,7-8,16H,5-6,9-14H2,1H3
InChIKeySLEKPSZLLBTGGK-UHFFFAOYSA-N
XLogP2.10
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds12
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(2-methoxyethoxy)ethyl]-3-phenoxypropan-1-amine
CID 62937995
3-(2-phenoxyethoxy)-N-propylpropan-1-amine
CID 55133853
3-(2-methoxyethoxy)-N-[2-(3-methylphenoxy)ethyl]propan-1-amine
CID 103605684
ethane;2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxybenzene
CID 154643071
3-phenoxy-N-(3-phenoxypropyl)propan-1-amine;hydrochloride
CID 18793133
N-(2-methoxyethyl)-6-phenoxyhexan-1-amine
CID 64503530
1-(2-methoxyethoxy)-3-(3-phenoxypropylamino)propan-2-ol
CID 106989841
2-methyl-N-[3-(2-phenoxyethoxy)propyl]propan-1-amine
CID 62456357
N-[2-(2-chloroethoxy)ethyl]-3-phenoxypropan-1-amine
CID 65023904
N-[2-[2-(4-ethoxyphenoxy)ethoxy]ethyl]-3-methoxypropan-1-amine
CID 2923613
3-methoxy-N-[2-[2-(4-methylphenoxy)ethoxy]ethyl]propan-1-amine
CID 2869969
N-[2-(2-phenoxyethoxy)ethyl]hexan-1-amine
CID 62564835

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyethoxy)-N-(3-phenoxypropyl)propan-1-amine?
The IUPAC name of 3-(2-methoxyethoxy)-N-(3-phenoxypropyl)propan-1-amine (CID 103605643) is 3-(2-methoxyethoxy)-N-(3-phenoxypropyl)propan-1-amine.
What is the SMILES notation for 3-(2-methoxyethoxy)-N-(3-phenoxypropyl)propan-1-amine?
The canonical SMILES for 3-(2-methoxyethoxy)-N-(3-phenoxypropyl)propan-1-amine is COCCOCCCNCCCOc1ccccc1.
What is the InChIKey of 3-(2-methoxyethoxy)-N-(3-phenoxypropyl)propan-1-amine?
The InChIKey is SLEKPSZLLBTGGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO3/c1-17-13-14-18-11-5-9-16-10-6-12-19-15-7-3-2-4-8-15/h2-4,7-8,16H,5-6,9-14H2,1H3.
What are the key properties of 3-(2-methoxyethoxy)-N-(3-phenoxypropyl)propan-1-amine?
3-(2-methoxyethoxy)-N-(3-phenoxypropyl)propan-1-amine has a molecular weight of 267.37 g/mol, XLogP of 2.10, 12 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyethoxy)-N-(3-phenoxypropyl)propan-1-amine is sourced from PubChem (CID 103605643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).