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

C14H23NO2 — CID 14694037

IUPACN-[2-[4-(2-methoxyethyl)phenoxy]ethyl]propan-2-amine
SMILESCOCCc1ccc(OCCNC(C)C)cc1
InChIInChI=1S/C14H23NO2/c1-12(2)15-9-11-17-14-6-4-13(5-7-14)8-10-16-3/h4-7,12,15H,8-11H2,1-3H3
InChIKeyRQOUWVIILNHAHR-UHFFFAOYSA-N
MW237.34 g/mol
LogP2.25
Rot. Bonds8

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

N-[2-[4-(2-methoxyethyl)phenoxy]ethyl]propan-2-amine (PubChem CID 14694037) has the molecular formula C14H23NO2 and a molecular weight of 237.34 g/mol. Its IUPAC name is N-[2-[4-(2-methoxyethyl)phenoxy]ethyl]propan-2-amine.

Molecular Properties

Compound NameN-[2-[4-(2-methoxyethyl)phenoxy]ethyl]propan-2-amine
PubChem CID14694037
Molecular FormulaC14H23NO2
Molecular Weight237.34 g/mol
Exact Mass237.17
IUPAC NameN-[2-[4-(2-methoxyethyl)phenoxy]ethyl]propan-2-amine
SMILESCOCCc1ccc(OCCNC(C)C)cc1
InChIInChI=1S/C14H23NO2/c1-12(2)15-9-11-17-14-6-4-13(5-7-14)8-10-16-3/h4-7,12,15H,8-11H2,1-3H3
InChIKeyRQOUWVIILNHAHR-UHFFFAOYSA-N
XLogP2.25
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.34
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[2-[4-(2-methoxyethyl)phenoxy]ethyl]-3-methylbutan-1-amine
CID 55093446
N-[2-(4-methylphenoxy)ethyl]propan-2-amine
CID 17178065
methanol;1-[4-(2-methoxyethyl)phenoxy]-3-(propan-2-ylamino)propan-2-ol
CID 175047598
N-(furan-3-ylmethyl)-2-[4-(2-methoxyethyl)phenoxy]ethanamine
CID 62598072
N-propan-2-yl-4-[2-(propan-2-ylamino)ethoxy]aniline
CID 176845634
1-[4-(2-methoxyethyl)phenoxy]-3-(propan-2-ylamino)propan-2-ol;methylboronic acid
CID 22295643
N-[2-(4-propylphenoxy)ethyl]butan-2-amine
CID 62584206
1-methoxy-3-[4-(2-methoxyethyl)phenoxy]-N-propylpropan-2-amine
CID 107506757
N-[2-[2-(4-methoxyphenoxy)ethoxy]ethyl]propan-2-amine
CID 2280828
N-[2-[4-(trifluoromethyl)phenoxy]ethyl]propan-2-amine
CID 29080754
2-[4-(2-methoxyethyl)phenoxy]-N-[(5-methylthiophen-2-yl)methyl]ethanamine
CID 62597904
N-[2-[4-(2-methoxyethyl)phenoxy]ethyl]-N',N'-dimethylpropane-1,3-diamine
CID 62597043

Frequently Asked Questions

What is the IUPAC name of N-[2-[4-(2-methoxyethyl)phenoxy]ethyl]propan-2-amine?
The IUPAC name of N-[2-[4-(2-methoxyethyl)phenoxy]ethyl]propan-2-amine (CID 14694037) is N-[2-[4-(2-methoxyethyl)phenoxy]ethyl]propan-2-amine.
What is the SMILES notation for N-[2-[4-(2-methoxyethyl)phenoxy]ethyl]propan-2-amine?
The canonical SMILES for N-[2-[4-(2-methoxyethyl)phenoxy]ethyl]propan-2-amine is COCCc1ccc(OCCNC(C)C)cc1.
What is the InChIKey of N-[2-[4-(2-methoxyethyl)phenoxy]ethyl]propan-2-amine?
The InChIKey is RQOUWVIILNHAHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO2/c1-12(2)15-9-11-17-14-6-4-13(5-7-14)8-10-16-3/h4-7,12,15H,8-11H2,1-3H3.
What are the key properties of N-[2-[4-(2-methoxyethyl)phenoxy]ethyl]propan-2-amine?
N-[2-[4-(2-methoxyethyl)phenoxy]ethyl]propan-2-amine has a molecular weight of 237.34 g/mol, XLogP of 2.25, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[4-(2-methoxyethyl)phenoxy]ethyl]propan-2-amine is sourced from PubChem (CID 14694037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).