5-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)hexanamide

C13H28N2O3 — CID 82851354

IUPAC5-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)hexanamide
SMILESCOCCCN(CCOC)C(=O)CCCC(C)N
InChIInChI=1S/C13H28N2O3/c1-12(14)6-4-7-13(16)15(9-11-18-3)8-5-10-17-2/h12H,4-11,14H2,1-3H3
InChIKeyKXHLNCAITZEEHX-UHFFFAOYSA-N
MW260.38 g/mol
LogP1.02
Rot. Bonds11

About 5-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)hexanamide

5-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)hexanamide (PubChem CID 82851354) has the molecular formula C13H28N2O3 and a molecular weight of 260.38 g/mol. Its IUPAC name is 5-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)hexanamide.

Molecular Properties

Compound Name5-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)hexanamide
PubChem CID82851354
Molecular FormulaC13H28N2O3
Molecular Weight260.38 g/mol
Exact Mass260.21
IUPAC Name5-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)hexanamide
SMILESCOCCCN(CCOC)C(=O)CCCC(C)N
InChIInChI=1S/C13H28N2O3/c1-12(14)6-4-7-13(16)15(9-11-18-3)8-5-10-17-2/h12H,4-11,14H2,1-3H3
InChIKeyKXHLNCAITZEEHX-UHFFFAOYSA-N
XLogP1.02
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-bromo-N-(2-methoxyethyl)-N-(3-methoxypropyl)acetamide
CID 63678594
4-methoxy-N-(2-methoxyethyl)-N-(2-methylpropyl)butanamide
CID 78884888
5-amino-N-butyl-N-(2-hydroxyethyl)hexanamide
CID 82851620
2-chloro-N-(2-methoxyethyl)-N-(3-methoxypropyl)acetamide
CID 60981148
5-amino-N-butyl-N-ethylhexanamide
CID 82848623
5-amino-N,N-diethylhexanamide
CID 82848451
2-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)-3-methylpentanamide
CID 54880078
(2S)-5-methoxypentan-2-amine
CID 93315322
3-[2-methoxyethyl(3-methoxypropyl)amino]-2-methyl-3-oxopropanoic acid
CID 114896858
3-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)-3-phenylpropanamide
CID 60980754
6-amino-N-cyclopropyl-N-(2-methoxyethyl)-2-methylheptanamide
CID 65292086
2-amino-4-[2-methoxyethyl(3-methoxypropyl)amino]butanamide
CID 63055708

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)hexanamide?
The IUPAC name of 5-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)hexanamide (CID 82851354) is 5-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)hexanamide.
What is the SMILES notation for 5-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)hexanamide?
The canonical SMILES for 5-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)hexanamide is COCCCN(CCOC)C(=O)CCCC(C)N.
What is the InChIKey of 5-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)hexanamide?
The InChIKey is KXHLNCAITZEEHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O3/c1-12(14)6-4-7-13(16)15(9-11-18-3)8-5-10-17-2/h12H,4-11,14H2,1-3H3.
What are the key properties of 5-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)hexanamide?
5-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)hexanamide has a molecular weight of 260.38 g/mol, XLogP of 1.02, 11 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)hexanamide is sourced from PubChem (CID 82851354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).