N-(2-methoxyethyl)-6-phenoxyhexan-1-amine

C15H25NO2 — CID 64503530

IUPACN-(2-methoxyethyl)-6-phenoxyhexan-1-amine
SMILESCOCCNCCCCCCOc1ccccc1
InChIInChI=1S/C15H25NO2/c1-17-14-12-16-11-7-2-3-8-13-18-15-9-5-4-6-10-15/h4-6,9-10,16H,2-3,7-8,11-14H2,1H3
InChIKeyHIUDWMDUYHKQFY-UHFFFAOYSA-N
MW251.37 g/mol
LogP2.86
Rot. Bonds11

About N-(2-methoxyethyl)-6-phenoxyhexan-1-amine

N-(2-methoxyethyl)-6-phenoxyhexan-1-amine (PubChem CID 64503530) has the molecular formula C15H25NO2 and a molecular weight of 251.37 g/mol. Its IUPAC name is N-(2-methoxyethyl)-6-phenoxyhexan-1-amine.

Molecular Properties

Compound NameN-(2-methoxyethyl)-6-phenoxyhexan-1-amine
PubChem CID64503530
Molecular FormulaC15H25NO2
Molecular Weight251.37 g/mol
Exact Mass251.19
IUPAC NameN-(2-methoxyethyl)-6-phenoxyhexan-1-amine
SMILESCOCCNCCCCCCOc1ccccc1
InChIInChI=1S/C15H25NO2/c1-17-14-12-16-11-7-2-3-8-13-18-15-9-5-4-6-10-15/h4-6,9-10,16H,2-3,7-8,11-14H2,1H3
InChIKeyHIUDWMDUYHKQFY-UHFFFAOYSA-N
XLogP2.86
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 52.86
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-(2-methoxyethoxy)ethyl]-3-phenoxypropan-1-amine
CID 62937995
N-ethyl-5-phenoxypentan-1-amine
CID 54394184
N-(2-methoxyethyl)-4-(3-methoxyphenoxy)butan-1-amine
CID 62572887
3-(2-methoxyethoxy)-N-(3-phenoxypropyl)propan-1-amine
CID 103605643
4-(4-tert-butylphenoxy)-N-(2-methoxyethyl)butan-1-amine
CID 62572894
3-phenoxy-N-(3-phenoxypropyl)propan-1-amine;hydrochloride
CID 18793133
N-(2-methoxyethyl)-3-(4-methoxyphenoxy)propan-1-amine
CID 60683313
N-[2-(2-phenoxyethoxy)ethyl]hexan-1-amine
CID 62564835
4-bromo-N-(2-phenoxyethyl)butan-1-amine
CID 106844867
N-(2-methoxyethyl)-3-(3-methoxyphenoxy)propan-1-amine
CID 62573044
7-methyl-N-(3-phenoxypropyl)octan-1-amine
CID 103604921
3-(4-chlorophenoxy)-N-(2-methoxyethyl)propan-1-amine
CID 60683339

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-6-phenoxyhexan-1-amine?
The IUPAC name of N-(2-methoxyethyl)-6-phenoxyhexan-1-amine (CID 64503530) is N-(2-methoxyethyl)-6-phenoxyhexan-1-amine.
What is the SMILES notation for N-(2-methoxyethyl)-6-phenoxyhexan-1-amine?
The canonical SMILES for N-(2-methoxyethyl)-6-phenoxyhexan-1-amine is COCCNCCCCCCOc1ccccc1.
What is the InChIKey of N-(2-methoxyethyl)-6-phenoxyhexan-1-amine?
The InChIKey is HIUDWMDUYHKQFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO2/c1-17-14-12-16-11-7-2-3-8-13-18-15-9-5-4-6-10-15/h4-6,9-10,16H,2-3,7-8,11-14H2,1H3.
What are the key properties of N-(2-methoxyethyl)-6-phenoxyhexan-1-amine?
N-(2-methoxyethyl)-6-phenoxyhexan-1-amine has a molecular weight of 251.37 g/mol, XLogP of 2.86, 11 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-6-phenoxyhexan-1-amine is sourced from PubChem (CID 64503530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).