N-[2-[2-(2-ethoxyphenoxy)ethoxy]ethyl]propan-2-amine

C15H25NO3 — CID 3850725

IUPACN-[2-[2-(2-ethoxyphenoxy)ethoxy]ethyl]propan-2-amine
SMILESCCOc1ccccc1OCCOCCNC(C)C
InChIInChI=1S/C15H25NO3/c1-4-18-14-7-5-6-8-15(14)19-12-11-17-10-9-16-13(2)3/h5-8,13,16H,4,9-12H2,1-3H3
InChIKeySCPCUTARLQFSKN-UHFFFAOYSA-N
MW267.37 g/mol
LogP2.48
Rot. Bonds10

About N-[2-[2-(2-ethoxyphenoxy)ethoxy]ethyl]propan-2-amine

N-[2-[2-(2-ethoxyphenoxy)ethoxy]ethyl]propan-2-amine (PubChem CID 3850725) has the molecular formula C15H25NO3 and a molecular weight of 267.37 g/mol. Its IUPAC name is N-[2-[2-(2-ethoxyphenoxy)ethoxy]ethyl]propan-2-amine.

Molecular Properties

Compound NameN-[2-[2-(2-ethoxyphenoxy)ethoxy]ethyl]propan-2-amine
PubChem CID3850725
Molecular FormulaC15H25NO3
Molecular Weight267.37 g/mol
Exact Mass267.18
IUPAC NameN-[2-[2-(2-ethoxyphenoxy)ethoxy]ethyl]propan-2-amine
SMILESCCOc1ccccc1OCCOCCNC(C)C
InChIInChI=1S/C15H25NO3/c1-4-18-14-7-5-6-8-15(14)19-12-11-17-10-9-16-13(2)3/h5-8,13,16H,4,9-12H2,1-3H3
InChIKeySCPCUTARLQFSKN-UHFFFAOYSA-N
XLogP2.48
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 52.48
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-(2-ethoxyphenoxy)ethoxy]ethyl]-2-methoxyethanamine
CID 2280426
N-benzyl-2-[2-(2-ethoxyphenoxy)ethoxy]ethanamine
CID 2296532
2-[2-[2-(2-ethoxyphenoxy)ethoxy]ethoxy]-1-methyl-4-propan-2-ylbenzene
CID 2283913
1-ethoxy-2-[2-[2-(2-fluorophenoxy)ethoxy]ethoxy]benzene
CID 2283298
4-bromo-N-[2-(2-ethoxyphenoxy)ethyl]-3-methylbutan-2-amine
CID 113484943
1-bromo-N-[2-(2-ethoxyphenoxy)ethyl]-3-methylbutan-2-amine
CID 114009978
2-(2-ethoxyphenoxy)-N-(2-methylpropoxy)ethanamine
CID 82715408
N-[2-[2-(3-chlorophenoxy)ethoxy]ethyl]propan-2-amine
CID 2280848
N-[2-(3-phenoxypropoxy)ethyl]propan-2-amine
CID 62937312
N-[2-(2-ethoxyphenoxy)ethyl]-2-methylpropan-1-amine
CID 62454697
N-[2-[2-(4-methoxyphenoxy)ethoxy]ethyl]propan-2-amine
CID 2280828
N-benzyl-2-[2-(2-ethoxyphenoxy)ethoxy]ethanamine;oxalic acid
CID 2922259

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-(2-ethoxyphenoxy)ethoxy]ethyl]propan-2-amine?
The IUPAC name of N-[2-[2-(2-ethoxyphenoxy)ethoxy]ethyl]propan-2-amine (CID 3850725) is N-[2-[2-(2-ethoxyphenoxy)ethoxy]ethyl]propan-2-amine.
What is the SMILES notation for N-[2-[2-(2-ethoxyphenoxy)ethoxy]ethyl]propan-2-amine?
The canonical SMILES for N-[2-[2-(2-ethoxyphenoxy)ethoxy]ethyl]propan-2-amine is CCOc1ccccc1OCCOCCNC(C)C.
What is the InChIKey of N-[2-[2-(2-ethoxyphenoxy)ethoxy]ethyl]propan-2-amine?
The InChIKey is SCPCUTARLQFSKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO3/c1-4-18-14-7-5-6-8-15(14)19-12-11-17-10-9-16-13(2)3/h5-8,13,16H,4,9-12H2,1-3H3.
What are the key properties of N-[2-[2-(2-ethoxyphenoxy)ethoxy]ethyl]propan-2-amine?
N-[2-[2-(2-ethoxyphenoxy)ethoxy]ethyl]propan-2-amine has a molecular weight of 267.37 g/mol, XLogP of 2.48, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(2-ethoxyphenoxy)ethoxy]ethyl]propan-2-amine is sourced from PubChem (CID 3850725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).