N-ethyl-N-[2-[4-(methylaminomethyl)phenoxy]ethyl]propan-1-amine

C15H26N2O — CID 55074636

IUPACN-ethyl-N-[2-[4-(methylaminomethyl)phenoxy]ethyl]propan-1-amine
SMILESCCCN(CC)CCOc1ccc(CNC)cc1
InChIInChI=1S/C15H26N2O/c1-4-10-17(5-2)11-12-18-15-8-6-14(7-9-15)13-16-3/h6-9,16H,4-5,10-13H2,1-3H3
InChIKeyCHRVBKJLNGFLNN-UHFFFAOYSA-N
MW250.39 g/mol
LogP2.52
Rot. Bonds9

About N-ethyl-N-[2-[4-(methylaminomethyl)phenoxy]ethyl]propan-1-amine

N-ethyl-N-[2-[4-(methylaminomethyl)phenoxy]ethyl]propan-1-amine (PubChem CID 55074636) has the molecular formula C15H26N2O and a molecular weight of 250.39 g/mol. Its IUPAC name is N-ethyl-N-[2-[4-(methylaminomethyl)phenoxy]ethyl]propan-1-amine.

Molecular Properties

Compound NameN-ethyl-N-[2-[4-(methylaminomethyl)phenoxy]ethyl]propan-1-amine
PubChem CID55074636
Molecular FormulaC15H26N2O
Molecular Weight250.39 g/mol
Exact Mass250.20
IUPAC NameN-ethyl-N-[2-[4-(methylaminomethyl)phenoxy]ethyl]propan-1-amine
SMILESCCCN(CC)CCOc1ccc(CNC)cc1
InChIInChI=1S/C15H26N2O/c1-4-10-17(5-2)11-12-18-15-8-6-14(7-9-15)13-16-3/h6-9,16H,4-5,10-13H2,1-3H3
InChIKeyCHRVBKJLNGFLNN-UHFFFAOYSA-N
XLogP2.52
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-ethyl-N-[2-[4-(methylaminomethyl)phenoxy]ethyl]propan-1-amine 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

N,2-diethyl-N-[2-[4-(methylaminomethyl)phenoxy]ethyl]butan-1-amine
CID 62436768
N-ethyl-2,2,2-trifluoro-N-[2-[4-(methylaminomethyl)phenoxy]ethyl]ethanamine
CID 62426627
N-methyl-N-[2-[4-(methylaminomethyl)phenoxy]ethyl]butan-2-amine
CID 62419349
4-[2-[ethyl(propyl)amino]ethoxy]benzohydrazide
CID 55213633
N-ethyl-2-methoxy-N-[[4-(methylaminomethyl)phenyl]methyl]ethanamine
CID 62434714
N-[2-[4-(2-aminoethyl)phenoxy]ethyl]-N-propylpropan-1-amine
CID 43253445
N-[2-(4-methylphenoxy)ethyl]-N-propylpropan-1-amine
CID 5261957
4-[2-[ethyl(propyl)amino]ethoxy]benzenecarbothioamide
CID 43290637
2-[ethyl-[2-(4-propoxyphenoxy)ethyl]amino]ethanol
CID 60685463
N-methyl-1-[4-(2-pentoxyethoxy)phenyl]methanamine
CID 62451901
N'-ethyl-N-[(4-prop-2-enoxyphenyl)methyl]-N'-propylethane-1,2-diamine
CID 103720680
N-[2-(4-chlorophenoxy)ethyl]-N-propylpropan-1-amine
CID 5261961

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[2-[4-(methylaminomethyl)phenoxy]ethyl]propan-1-amine?
The IUPAC name of N-ethyl-N-[2-[4-(methylaminomethyl)phenoxy]ethyl]propan-1-amine (CID 55074636) is N-ethyl-N-[2-[4-(methylaminomethyl)phenoxy]ethyl]propan-1-amine.
What is the SMILES notation for N-ethyl-N-[2-[4-(methylaminomethyl)phenoxy]ethyl]propan-1-amine?
The canonical SMILES for N-ethyl-N-[2-[4-(methylaminomethyl)phenoxy]ethyl]propan-1-amine is CCCN(CC)CCOc1ccc(CNC)cc1.
What is the InChIKey of N-ethyl-N-[2-[4-(methylaminomethyl)phenoxy]ethyl]propan-1-amine?
The InChIKey is CHRVBKJLNGFLNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O/c1-4-10-17(5-2)11-12-18-15-8-6-14(7-9-15)13-16-3/h6-9,16H,4-5,10-13H2,1-3H3.
What are the key properties of N-ethyl-N-[2-[4-(methylaminomethyl)phenoxy]ethyl]propan-1-amine?
N-ethyl-N-[2-[4-(methylaminomethyl)phenoxy]ethyl]propan-1-amine has a molecular weight of 250.39 g/mol, XLogP of 2.52, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[2-[4-(methylaminomethyl)phenoxy]ethyl]propan-1-amine is sourced from PubChem (CID 55074636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).