2-(2-chlorophenyl)-5-methoxy-N-(2-methoxyethyl)pentan-1-amine

C15H24ClNO2 — CID 79449341

IUPAC2-(2-chlorophenyl)-5-methoxy-N-(2-methoxyethyl)pentan-1-amine
SMILESCOCCCC(CNCCOC)c1ccccc1Cl
InChIInChI=1S/C15H24ClNO2/c1-18-10-5-6-13(12-17-9-11-19-2)14-7-3-4-8-15(14)16/h3-4,7-8,13,17H,5-6,9-12H2,1-2H3
InChIKeyGUSFSOZHRUHHBS-UHFFFAOYSA-N
MW285.81 g/mol
LogP3.09
Rot. Bonds10

About 2-(2-chlorophenyl)-5-methoxy-N-(2-methoxyethyl)pentan-1-amine

2-(2-chlorophenyl)-5-methoxy-N-(2-methoxyethyl)pentan-1-amine (PubChem CID 79449341) has the molecular formula C15H24ClNO2 and a molecular weight of 285.81 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-5-methoxy-N-(2-methoxyethyl)pentan-1-amine.

Molecular Properties

Compound Name2-(2-chlorophenyl)-5-methoxy-N-(2-methoxyethyl)pentan-1-amine
PubChem CID79449341
Molecular FormulaC15H24ClNO2
Molecular Weight285.81 g/mol
Exact Mass285.15
IUPAC Name2-(2-chlorophenyl)-5-methoxy-N-(2-methoxyethyl)pentan-1-amine
SMILESCOCCCC(CNCCOC)c1ccccc1Cl
InChIInChI=1S/C15H24ClNO2/c1-18-10-5-6-13(12-17-9-11-19-2)14-7-3-4-8-15(14)16/h3-4,7-8,13,17H,5-6,9-12H2,1-2H3
InChIKeyGUSFSOZHRUHHBS-UHFFFAOYSA-N
XLogP3.09
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.81
LogP ≤ 53.09
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-(2-chlorophenyl)-N-(2-methoxyethyl)-4-propoxybutan-1-amine
CID 106457186
2-(2-chlorophenyl)-5-methoxy-N-(2-methoxyethyl)-5-methylhexan-1-amine
CID 103036937
2-(2-chlorophenyl)-5-ethoxy-N-propylpentan-1-amine
CID 79448818
2-(2-chlorophenyl)-N-(2-methoxyethyl)propan-1-amine
CID 66438264
2-(2-fluorophenyl)-5-methoxy-N-propylpentan-1-amine
CID 79439292
[1-(2-chlorophenyl)-4-methoxybutyl]hydrazine
CID 105211131
2-(2-chlorophenyl)-5-(2-methoxyethoxy)pentan-1-amine
CID 103412655
2-(2-chlorophenyl)-5-ethylsulfonyl-N-propylpentan-1-amine
CID 79436264
2-(2-bromophenyl)-6-methoxy-N-propylhexan-1-amine
CID 104649517
2-(2-fluorophenyl)-4-(2-methoxyethoxy)-N-(2-methoxyethyl)butan-1-amine
CID 79436793
2-(3-fluorophenyl)-6-methoxy-N-(2-methoxyethyl)hexan-1-amine
CID 104649483
2-(4-chlorophenyl)-N-(2-methoxyethyl)-6-methylheptan-1-amine
CID 83169176

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-5-methoxy-N-(2-methoxyethyl)pentan-1-amine?
The IUPAC name of 2-(2-chlorophenyl)-5-methoxy-N-(2-methoxyethyl)pentan-1-amine (CID 79449341) is 2-(2-chlorophenyl)-5-methoxy-N-(2-methoxyethyl)pentan-1-amine.
What is the SMILES notation for 2-(2-chlorophenyl)-5-methoxy-N-(2-methoxyethyl)pentan-1-amine?
The canonical SMILES for 2-(2-chlorophenyl)-5-methoxy-N-(2-methoxyethyl)pentan-1-amine is COCCCC(CNCCOC)c1ccccc1Cl.
What is the InChIKey of 2-(2-chlorophenyl)-5-methoxy-N-(2-methoxyethyl)pentan-1-amine?
The InChIKey is GUSFSOZHRUHHBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24ClNO2/c1-18-10-5-6-13(12-17-9-11-19-2)14-7-3-4-8-15(14)16/h3-4,7-8,13,17H,5-6,9-12H2,1-2H3.
What are the key properties of 2-(2-chlorophenyl)-5-methoxy-N-(2-methoxyethyl)pentan-1-amine?
2-(2-chlorophenyl)-5-methoxy-N-(2-methoxyethyl)pentan-1-amine has a molecular weight of 285.81 g/mol, XLogP of 3.09, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-5-methoxy-N-(2-methoxyethyl)pentan-1-amine is sourced from PubChem (CID 79449341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).