N-[5-[2-(5-acetamidopentoxy)ethoxy]pentyl]-2-propan-2-yloxyacetamide

C19H38N2O5 — CID 142616275

IUPACN-[5-[2-(5-acetamidopentoxy)ethoxy]pentyl]-2-propan-2-yloxyacetamide
SMILESCC(=O)NCCCCCOCCOCCCCCNC(=O)COC(C)C
InChIInChI=1S/C19H38N2O5/c1-17(2)26-16-19(23)21-11-7-5-9-13-25-15-14-24-12-8-4-6-10-20-18(3)22/h17H,4-16H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyMMTOYJDSXLVNNH-UHFFFAOYSA-N
MW374.52 g/mol
LogP2.04
Rot. Bonds18

About N-[5-[2-(5-acetamidopentoxy)ethoxy]pentyl]-2-propan-2-yloxyacetamide

N-[5-[2-(5-acetamidopentoxy)ethoxy]pentyl]-2-propan-2-yloxyacetamide (PubChem CID 142616275) has the molecular formula C19H38N2O5 and a molecular weight of 374.52 g/mol. Its IUPAC name is N-[5-[2-(5-acetamidopentoxy)ethoxy]pentyl]-2-propan-2-yloxyacetamide.

Molecular Properties

Compound NameN-[5-[2-(5-acetamidopentoxy)ethoxy]pentyl]-2-propan-2-yloxyacetamide
PubChem CID142616275
Molecular FormulaC19H38N2O5
Molecular Weight374.52 g/mol
Exact Mass374.28
IUPAC NameN-[5-[2-(5-acetamidopentoxy)ethoxy]pentyl]-2-propan-2-yloxyacetamide
SMILESCC(=O)NCCCCCOCCOCCCCCNC(=O)COC(C)C
InChIInChI=1S/C19H38N2O5/c1-17(2)26-16-19(23)21-11-7-5-9-13-25-15-14-24-12-8-4-6-10-20-18(3)22/h17H,4-16H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyMMTOYJDSXLVNNH-UHFFFAOYSA-N
XLogP2.04
TPSA85.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds18
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.52
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-[2-[2-[2-(2-acetamidoethoxy)ethoxy]ethoxy]ethyl]-2-propan-2-yloxyacetamide
CID 142616578
N-[5-[2-(6-methylheptoxy)ethoxy]pentyl]-2-propan-2-yloxyacetamide
CID 138727601
N-[2-(2-acetamidoethoxy)ethyl]-2-propan-2-yloxyacetamide
CID 142616646
N-[4-[2-[2-[2-[2-[2-(5-methyl-4-oxohexoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]butyl]-2-propan-2-yloxyacetamide
CID 165106125
N-[2-[2-(5-acetamidopentoxy)ethoxy]ethyl]-2-methoxyacetamide
CID 155056819
N-[5-(5-acetamidopentoxy)pentyl]-2-methoxyacetamide;ethane
CID 163400462
2-methyl-N-[5-[(2-propan-2-yloxyacetyl)amino]pentyl]propanamide
CID 138728413
N-[8-(methylamino)octyl]-2-propan-2-yloxyacetamide
CID 154671213
N-[5-[2-[5-(2-fluoro-3-formamidopropoxy)pentoxy]ethoxy]pentyl]-2-propan-2-yloxyacetamide
CID 157048797
N-[8-(phosphanylcarbonylamino)octyl]-2-propan-2-yloxyacetamide
CID 157048781
N-[5-[2-[5-(2-fluoro-3-formamidopropoxy)pentoxy]ethoxy]pentyl]-2-propan-2-yloxyacetamide;propane
CID 157048796
N-(5-formamidopentyl)-2-propan-2-yloxyacetamide
CID 155740899

Frequently Asked Questions

What is the IUPAC name of N-[5-[2-(5-acetamidopentoxy)ethoxy]pentyl]-2-propan-2-yloxyacetamide?
The IUPAC name of N-[5-[2-(5-acetamidopentoxy)ethoxy]pentyl]-2-propan-2-yloxyacetamide (CID 142616275) is N-[5-[2-(5-acetamidopentoxy)ethoxy]pentyl]-2-propan-2-yloxyacetamide.
What is the SMILES notation for N-[5-[2-(5-acetamidopentoxy)ethoxy]pentyl]-2-propan-2-yloxyacetamide?
The canonical SMILES for N-[5-[2-(5-acetamidopentoxy)ethoxy]pentyl]-2-propan-2-yloxyacetamide is CC(=O)NCCCCCOCCOCCCCCNC(=O)COC(C)C.
What is the InChIKey of N-[5-[2-(5-acetamidopentoxy)ethoxy]pentyl]-2-propan-2-yloxyacetamide?
The InChIKey is MMTOYJDSXLVNNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H38N2O5/c1-17(2)26-16-19(23)21-11-7-5-9-13-25-15-14-24-12-8-4-6-10-20-18(3)22/h17H,4-16H2,1-3H3,(H,20,22)(H,21,23).
What are the key properties of N-[5-[2-(5-acetamidopentoxy)ethoxy]pentyl]-2-propan-2-yloxyacetamide?
N-[5-[2-(5-acetamidopentoxy)ethoxy]pentyl]-2-propan-2-yloxyacetamide has a molecular weight of 374.52 g/mol, XLogP of 2.04, 18 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[2-(5-acetamidopentoxy)ethoxy]pentyl]-2-propan-2-yloxyacetamide is sourced from PubChem (CID 142616275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).