1-(4-ethoxyoxan-4-yl)-N-methyl-1-phenylmethanamine

C15H23NO2 — CID 116765565

IUPAC1-(4-ethoxyoxan-4-yl)-N-methyl-1-phenylmethanamine
SMILESCCOC1(C(NC)c2ccccc2)CCOCC1
InChIInChI=1S/C15H23NO2/c1-3-18-15(9-11-17-12-10-15)14(16-2)13-7-5-4-6-8-13/h4-8,14,16H,3,9-12H2,1-2H3
InChIKeyAKWKJPBIKRGXQM-UHFFFAOYSA-N
MW249.35 g/mol
LogP2.53
Rot. Bonds5

About 1-(4-ethoxyoxan-4-yl)-N-methyl-1-phenylmethanamine

1-(4-ethoxyoxan-4-yl)-N-methyl-1-phenylmethanamine (PubChem CID 116765565) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is 1-(4-ethoxyoxan-4-yl)-N-methyl-1-phenylmethanamine.

Molecular Properties

Compound Name1-(4-ethoxyoxan-4-yl)-N-methyl-1-phenylmethanamine
PubChem CID116765565
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name1-(4-ethoxyoxan-4-yl)-N-methyl-1-phenylmethanamine
SMILESCCOC1(C(NC)c2ccccc2)CCOCC1
InChIInChI=1S/C15H23NO2/c1-3-18-15(9-11-17-12-10-15)14(16-2)13-7-5-4-6-8-13/h4-8,14,16H,3,9-12H2,1-2H3
InChIKeyAKWKJPBIKRGXQM-UHFFFAOYSA-N
XLogP2.53
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(4-ethoxyoxan-4-yl)-N-methyl-1-phenylmethanamine 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

1-(4-chlorophenyl)-1-(4-ethoxyoxan-4-yl)-N-methylmethanamine
CID 116765668
N-[(4-ethoxyoxan-4-yl)-phenylmethyl]propan-1-amine
CID 116765963
1-(4-ethoxyoxan-4-yl)-1-(3-methoxyphenyl)-N-methylmethanamine
CID 116765647
1-(4-ethoxyoxan-4-yl)-N-methyl-1-(2-methylphenyl)methanamine
CID 116765719
1-(3,4-difluorophenyl)-1-(4-ethoxyoxan-4-yl)-N-methylmethanamine
CID 116765724
(4-ethoxyoxan-4-yl)-phenylmethanamine
CID 116765292
1-(2,3-dimethylphenyl)-1-(4-ethoxyoxan-4-yl)-N-methylmethanamine
CID 116765595
1-(1-ethoxycyclopentyl)-N-methyl-1-(4-propan-2-ylphenyl)methanamine
CID 116761869
N-[(1-ethoxycyclopentyl)-phenylmethyl]ethanamine
CID 116762125
[(4-ethoxyoxan-4-yl)-(2-methylphenyl)methyl]hydrazine
CID 105276746
1-(4-methoxyoxan-4-yl)-N-methyl-1-(4-propan-2-ylphenyl)methanamine
CID 116764616
N-[(1-ethoxycyclohexyl)-phenylmethyl]propan-1-amine
CID 116764179

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethoxyoxan-4-yl)-N-methyl-1-phenylmethanamine?
The IUPAC name of 1-(4-ethoxyoxan-4-yl)-N-methyl-1-phenylmethanamine (CID 116765565) is 1-(4-ethoxyoxan-4-yl)-N-methyl-1-phenylmethanamine.
What is the SMILES notation for 1-(4-ethoxyoxan-4-yl)-N-methyl-1-phenylmethanamine?
The canonical SMILES for 1-(4-ethoxyoxan-4-yl)-N-methyl-1-phenylmethanamine is CCOC1(C(NC)c2ccccc2)CCOCC1.
What is the InChIKey of 1-(4-ethoxyoxan-4-yl)-N-methyl-1-phenylmethanamine?
The InChIKey is AKWKJPBIKRGXQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-3-18-15(9-11-17-12-10-15)14(16-2)13-7-5-4-6-8-13/h4-8,14,16H,3,9-12H2,1-2H3.
What are the key properties of 1-(4-ethoxyoxan-4-yl)-N-methyl-1-phenylmethanamine?
1-(4-ethoxyoxan-4-yl)-N-methyl-1-phenylmethanamine has a molecular weight of 249.35 g/mol, XLogP of 2.53, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethoxyoxan-4-yl)-N-methyl-1-phenylmethanamine is sourced from PubChem (CID 116765565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).