1-[4-(2-methoxyethyl)phenoxy]-N-methylpentan-2-amine

C15H25NO2 — CID 62044092

IUPAC1-[4-(2-methoxyethyl)phenoxy]-N-methylpentan-2-amine
SMILESCCCC(COc1ccc(CCOC)cc1)NC
InChIInChI=1S/C15H25NO2/c1-4-5-14(16-2)12-18-15-8-6-13(7-9-15)10-11-17-3/h6-9,14,16H,4-5,10-12H2,1-3H3
InChIKeyBASIRTWYZNBAES-UHFFFAOYSA-N
MW251.37 g/mol
LogP2.64
Rot. Bonds9

About 1-[4-(2-methoxyethyl)phenoxy]-N-methylpentan-2-amine

1-[4-(2-methoxyethyl)phenoxy]-N-methylpentan-2-amine (PubChem CID 62044092) has the molecular formula C15H25NO2 and a molecular weight of 251.37 g/mol. Its IUPAC name is 1-[4-(2-methoxyethyl)phenoxy]-N-methylpentan-2-amine.

Molecular Properties

Compound Name1-[4-(2-methoxyethyl)phenoxy]-N-methylpentan-2-amine
PubChem CID62044092
Molecular FormulaC15H25NO2
Molecular Weight251.37 g/mol
Exact Mass251.19
IUPAC Name1-[4-(2-methoxyethyl)phenoxy]-N-methylpentan-2-amine
SMILESCCCC(COc1ccc(CCOC)cc1)NC
InChIInChI=1S/C15H25NO2/c1-4-5-14(16-2)12-18-15-8-6-13(7-9-15)10-11-17-3/h6-9,14,16H,4-5,10-12H2,1-3H3
InChIKeyBASIRTWYZNBAES-UHFFFAOYSA-N
XLogP2.64
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-1-(4-propylphenoxy)pentan-2-amine
CID 62548560
3-[4-(2-methoxyethyl)phenoxy]-2-(methylamino)propan-1-ol
CID 64807086
1-methoxy-3-[4-(2-methoxyethyl)phenoxy]-N-propylpropan-2-amine
CID 107506757
N-methyl-1-(4-phenoxyphenoxy)pentan-2-amine
CID 63474716
1-(4-ethylphenoxy)-N-methylbutan-2-amine
CID 62038493
1-(4-chlorophenoxy)-N-methylhexan-2-amine
CID 105125626
1-(4-chlorophenoxy)-3-methoxy-N-methylpropan-2-amine
CID 105165684
N-methyl-1-phenoxynonan-2-amine
CID 63416660
(2S)-2-[[(2R)-2-hydroxy-3-[4-(2-methoxyethyl)phenoxy]propyl]amino]butan-1-ol
CID 25186198
3-[4-(2-methoxyethyl)phenoxy]-2-methylpropanoic acid
CID 43538057
1-(2,3-dihydro-1H-inden-5-yloxy)-N-methylpentan-2-amine
CID 62043866
6-methoxy-N-methyl-1-phenylhexan-3-amine
CID 62602732

Frequently Asked Questions

What is the IUPAC name of 1-[4-(2-methoxyethyl)phenoxy]-N-methylpentan-2-amine?
The IUPAC name of 1-[4-(2-methoxyethyl)phenoxy]-N-methylpentan-2-amine (CID 62044092) is 1-[4-(2-methoxyethyl)phenoxy]-N-methylpentan-2-amine.
What is the SMILES notation for 1-[4-(2-methoxyethyl)phenoxy]-N-methylpentan-2-amine?
The canonical SMILES for 1-[4-(2-methoxyethyl)phenoxy]-N-methylpentan-2-amine is CCCC(COc1ccc(CCOC)cc1)NC.
What is the InChIKey of 1-[4-(2-methoxyethyl)phenoxy]-N-methylpentan-2-amine?
The InChIKey is BASIRTWYZNBAES-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO2/c1-4-5-14(16-2)12-18-15-8-6-13(7-9-15)10-11-17-3/h6-9,14,16H,4-5,10-12H2,1-3H3.
What are the key properties of 1-[4-(2-methoxyethyl)phenoxy]-N-methylpentan-2-amine?
1-[4-(2-methoxyethyl)phenoxy]-N-methylpentan-2-amine has a molecular weight of 251.37 g/mol, XLogP of 2.64, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(2-methoxyethyl)phenoxy]-N-methylpentan-2-amine is sourced from PubChem (CID 62044092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).