2-ethyl-N-(2-methoxyethyl)-5-phenoxypentan-1-amine

C16H27NO2 — CID 62936301

IUPAC2-ethyl-N-(2-methoxyethyl)-5-phenoxypentan-1-amine
SMILESCCC(CCCOc1ccccc1)CNCCOC
InChIInChI=1S/C16H27NO2/c1-3-15(14-17-11-13-18-2)8-7-12-19-16-9-5-4-6-10-16/h4-6,9-10,15,17H,3,7-8,11-14H2,1-2H3
InChIKeyCWZYBBVQCWAJSM-UHFFFAOYSA-N
MW265.40 g/mol
LogP3.11
Rot. Bonds11

About 2-ethyl-N-(2-methoxyethyl)-5-phenoxypentan-1-amine

2-ethyl-N-(2-methoxyethyl)-5-phenoxypentan-1-amine (PubChem CID 62936301) has the molecular formula C16H27NO2 and a molecular weight of 265.40 g/mol. Its IUPAC name is 2-ethyl-N-(2-methoxyethyl)-5-phenoxypentan-1-amine.

Molecular Properties

Compound Name2-ethyl-N-(2-methoxyethyl)-5-phenoxypentan-1-amine
PubChem CID62936301
Molecular FormulaC16H27NO2
Molecular Weight265.40 g/mol
Exact Mass265.20
IUPAC Name2-ethyl-N-(2-methoxyethyl)-5-phenoxypentan-1-amine
SMILESCCC(CCCOc1ccccc1)CNCCOC
InChIInChI=1S/C16H27NO2/c1-3-15(14-17-11-13-18-2)8-7-12-19-16-9-5-4-6-10-16/h4-6,9-10,15,17H,3,7-8,11-14H2,1-2H3
InChIKeyCWZYBBVQCWAJSM-UHFFFAOYSA-N
XLogP3.11
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 53.11
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

2-ethyl-N-(2-methylpropyl)-5-phenoxypentan-1-amine
CID 62936468
2-benzyl-N-(2-methoxyethyl)hexan-1-amine
CID 62725458
N-(2-methoxyethyl)-6-phenoxyhexan-1-amine
CID 64503530
2-ethyl-N-(2-methoxyethyl)pentan-1-amine
CID 62718813
2-benzyl-6-methoxy-N-(2-methoxyethyl)hexan-1-amine
CID 104649362
4-[2-(2-ethylhexylamino)ethoxy]benzoic acid
CID 107816740
N-methyl-5-phenoxy-2-propylpentan-1-amine
CID 55156688
2-ethyl-5-ethylsulfonyl-N-(2-methoxyethyl)pentan-1-amine
CID 65097077
2-[(2-bromophenyl)methyl]-5-methoxy-N-(2-methoxyethyl)pentan-1-amine
CID 62718705
2-ethyl-N-[2-(4-nitrophenoxy)ethyl]hexan-1-amine
CID 107820074
N-[2-(2-methoxyethoxy)ethyl]-3-phenoxypropan-1-amine
CID 62937995
3-[2-[(2-ethyl-4-hydroxybutyl)amino]ethoxy]benzoic acid
CID 103258996

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-(2-methoxyethyl)-5-phenoxypentan-1-amine?
The IUPAC name of 2-ethyl-N-(2-methoxyethyl)-5-phenoxypentan-1-amine (CID 62936301) is 2-ethyl-N-(2-methoxyethyl)-5-phenoxypentan-1-amine.
What is the SMILES notation for 2-ethyl-N-(2-methoxyethyl)-5-phenoxypentan-1-amine?
The canonical SMILES for 2-ethyl-N-(2-methoxyethyl)-5-phenoxypentan-1-amine is CCC(CCCOc1ccccc1)CNCCOC.
What is the InChIKey of 2-ethyl-N-(2-methoxyethyl)-5-phenoxypentan-1-amine?
The InChIKey is CWZYBBVQCWAJSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27NO2/c1-3-15(14-17-11-13-18-2)8-7-12-19-16-9-5-4-6-10-16/h4-6,9-10,15,17H,3,7-8,11-14H2,1-2H3.
What are the key properties of 2-ethyl-N-(2-methoxyethyl)-5-phenoxypentan-1-amine?
2-ethyl-N-(2-methoxyethyl)-5-phenoxypentan-1-amine has a molecular weight of 265.40 g/mol, XLogP of 3.11, 11 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-(2-methoxyethyl)-5-phenoxypentan-1-amine is sourced from PubChem (CID 62936301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).