N-[1-[2-(2-aminopropoxy)ethoxy]propan-2-yl]acetamide

C10H22N2O3 — CID 58153232

IUPACN-[1-[2-(2-aminopropoxy)ethoxy]propan-2-yl]acetamide
SMILESCC(=O)NC(C)COCCOCC(C)N
InChIInChI=1S/C10H22N2O3/c1-8(11)6-14-4-5-15-7-9(2)12-10(3)13/h8-9H,4-7,11H2,1-3H3,(H,12,13)
InChIKeyKSZDWDNOJKJDLP-UHFFFAOYSA-N
MW218.30 g/mol
LogP-0.11
Rot. Bonds8

About N-[1-[2-(2-aminopropoxy)ethoxy]propan-2-yl]acetamide

N-[1-[2-(2-aminopropoxy)ethoxy]propan-2-yl]acetamide (PubChem CID 58153232) has the molecular formula C10H22N2O3 and a molecular weight of 218.30 g/mol. Its IUPAC name is N-[1-[2-(2-aminopropoxy)ethoxy]propan-2-yl]acetamide.

Molecular Properties

Compound NameN-[1-[2-(2-aminopropoxy)ethoxy]propan-2-yl]acetamide
PubChem CID58153232
Molecular FormulaC10H22N2O3
Molecular Weight218.30 g/mol
Exact Mass218.16
IUPAC NameN-[1-[2-(2-aminopropoxy)ethoxy]propan-2-yl]acetamide
SMILESCC(=O)NC(C)COCCOCC(C)N
InChIInChI=1S/C10H22N2O3/c1-8(11)6-14-4-5-15-7-9(2)12-10(3)13/h8-9H,4-7,11H2,1-3H3,(H,12,13)
InChIKeyKSZDWDNOJKJDLP-UHFFFAOYSA-N
XLogP-0.11
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 5-0.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[1-[2-(2-aminopropoxy)ethoxy]propan-2-yl]acetamide?
The IUPAC name of N-[1-[2-(2-aminopropoxy)ethoxy]propan-2-yl]acetamide (CID 58153232) is N-[1-[2-(2-aminopropoxy)ethoxy]propan-2-yl]acetamide.
What is the SMILES notation for N-[1-[2-(2-aminopropoxy)ethoxy]propan-2-yl]acetamide?
The canonical SMILES for N-[1-[2-(2-aminopropoxy)ethoxy]propan-2-yl]acetamide is CC(=O)NC(C)COCCOCC(C)N.
What is the InChIKey of N-[1-[2-(2-aminopropoxy)ethoxy]propan-2-yl]acetamide?
The InChIKey is KSZDWDNOJKJDLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O3/c1-8(11)6-14-4-5-15-7-9(2)12-10(3)13/h8-9H,4-7,11H2,1-3H3,(H,12,13).
What are the key properties of N-[1-[2-(2-aminopropoxy)ethoxy]propan-2-yl]acetamide?
N-[1-[2-(2-aminopropoxy)ethoxy]propan-2-yl]acetamide has a molecular weight of 218.30 g/mol, XLogP of -0.11, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[2-(2-aminopropoxy)ethoxy]propan-2-yl]acetamide is sourced from PubChem (CID 58153232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).