2-(5-methoxypentylamino)-N-(2-methylbutan-2-yl)acetamide

C13H28N2O2 — CID 114130456

IUPAC2-(5-methoxypentylamino)-N-(2-methylbutan-2-yl)acetamide
SMILESCCC(C)(C)NC(=O)CNCCCCCOC
InChIInChI=1S/C13H28N2O2/c1-5-13(2,3)15-12(16)11-14-9-7-6-8-10-17-4/h14H,5-11H2,1-4H3,(H,15,16)
InChIKeyIABCVEHAHLJYJR-UHFFFAOYSA-N
MW244.38 g/mol
LogP1.70
Rot. Bonds10

About 2-(5-methoxypentylamino)-N-(2-methylbutan-2-yl)acetamide

2-(5-methoxypentylamino)-N-(2-methylbutan-2-yl)acetamide (PubChem CID 114130456) has the molecular formula C13H28N2O2 and a molecular weight of 244.38 g/mol. Its IUPAC name is 2-(5-methoxypentylamino)-N-(2-methylbutan-2-yl)acetamide.

Molecular Properties

Compound Name2-(5-methoxypentylamino)-N-(2-methylbutan-2-yl)acetamide
PubChem CID114130456
Molecular FormulaC13H28N2O2
Molecular Weight244.38 g/mol
Exact Mass244.22
IUPAC Name2-(5-methoxypentylamino)-N-(2-methylbutan-2-yl)acetamide
SMILESCCC(C)(C)NC(=O)CNCCCCCOC
InChIInChI=1S/C13H28N2O2/c1-5-13(2,3)15-12(16)11-14-9-7-6-8-10-17-4/h14H,5-11H2,1-4H3,(H,15,16)
InChIKeyIABCVEHAHLJYJR-UHFFFAOYSA-N
XLogP1.70
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(3-ethoxypropylamino)-N-(2-methylbutan-2-yl)acetamide
CID 60672261
2-(2-hydroxyethylamino)-N-(2-methylbutan-2-yl)acetamide
CID 60671300
2-(2-methoxyethylamino)-N-(2-methylpentan-2-yl)acetamide
CID 115738896
N-(2-methylbutan-2-yl)-2-(pent-4-ynylamino)acetamide
CID 106221318
N-tert-butyl-3-(4-methoxybutylamino)propanamide
CID 115605378
N-(2-methoxyethyl)-2-(nonylamino)acetamide
CID 115574845
2-(hexylamino)-N-(2-methoxyethyl)acetamide
CID 60649576
2-(4-methoxybutylamino)-N-pentan-2-ylacetamide
CID 60976896
2-(2-but-3-enoxyethylamino)-N-(2-methylbutan-2-yl)acetamide
CID 106401580
3-(6-methoxyhexylamino)-N-methylpropanamide
CID 143379158
2-(cyclopentylmethylamino)-N-(2-methylbutan-2-yl)acetamide
CID 61486055
2-(6-hydroxyhexylamino)-N-(2-methoxyethyl)acetamide
CID 107703585

Frequently Asked Questions

What is the IUPAC name of 2-(5-methoxypentylamino)-N-(2-methylbutan-2-yl)acetamide?
The IUPAC name of 2-(5-methoxypentylamino)-N-(2-methylbutan-2-yl)acetamide (CID 114130456) is 2-(5-methoxypentylamino)-N-(2-methylbutan-2-yl)acetamide.
What is the SMILES notation for 2-(5-methoxypentylamino)-N-(2-methylbutan-2-yl)acetamide?
The canonical SMILES for 2-(5-methoxypentylamino)-N-(2-methylbutan-2-yl)acetamide is CCC(C)(C)NC(=O)CNCCCCCOC.
What is the InChIKey of 2-(5-methoxypentylamino)-N-(2-methylbutan-2-yl)acetamide?
The InChIKey is IABCVEHAHLJYJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O2/c1-5-13(2,3)15-12(16)11-14-9-7-6-8-10-17-4/h14H,5-11H2,1-4H3,(H,15,16).
What are the key properties of 2-(5-methoxypentylamino)-N-(2-methylbutan-2-yl)acetamide?
2-(5-methoxypentylamino)-N-(2-methylbutan-2-yl)acetamide has a molecular weight of 244.38 g/mol, XLogP of 1.70, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methoxypentylamino)-N-(2-methylbutan-2-yl)acetamide is sourced from PubChem (CID 114130456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).