2-(3-aminopropoxy)acetamide

C5H12N2O2 — CID 62344224

IUPAC2-(3-aminopropoxy)acetamide
SMILESNCCCOCC(N)=O
InChIInChI=1S/C5H12N2O2/c6-2-1-3-9-4-5(7)8/h1-4,6H2,(H2,7,8)
InChIKeyUXKJTTFYGPSDIE-UHFFFAOYSA-N
MW132.16 g/mol
LogP-1.16
Rot. Bonds5

About 2-(3-aminopropoxy)acetamide

2-(3-aminopropoxy)acetamide (PubChem CID 62344224) has the molecular formula C5H12N2O2 and a molecular weight of 132.16 g/mol. Its IUPAC name is 2-(3-aminopropoxy)acetamide.

Molecular Properties

Compound Name2-(3-aminopropoxy)acetamide
PubChem CID62344224
Molecular FormulaC5H12N2O2
Molecular Weight132.16 g/mol
Exact Mass132.09
IUPAC Name2-(3-aminopropoxy)acetamide
SMILESNCCCOCC(N)=O
InChIInChI=1S/C5H12N2O2/c6-2-1-3-9-4-5(7)8/h1-4,6H2,(H2,7,8)
InChIKeyUXKJTTFYGPSDIE-UHFFFAOYSA-N
XLogP-1.16
TPSA78.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.16
LogP ≤ 5-1.16
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-[4-(4-aminobutoxy)butoxy]acetamide
CID 155031633
2-[2-[2-[2-[2-[2-(2-amino-2-oxoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]acetamide
CID 175962657
2-tridecoxyacetamide
CID 54483018
2-[2-[2-(2-pentoxyethoxy)ethoxy]ethoxy]acetamide
CID 171838427
2-[2-(2-octoxyethoxy)ethoxy]acetamide
CID 57274402
2-[3-(4-methoxybutoxy)propoxy]acetamide
CID 142367848
6-amino-N-[2-(2-amino-2-oxoethoxy)ethyl]hexanamide
CID 106236522
3-(3-aminopropoxy)propan-1-amine;ethane
CID 23031033
2-[2-(4-oxopentoxy)ethoxy]acetamide
CID 122436040
2-[2-[2-(2-bromoethoxy)ethoxy]ethoxy]acetamide
CID 154729285
2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]acetamide
CID 87940620
3-aminopropyl 2-(butoxymethyl)prop-2-enoate
CID 174450867

Frequently Asked Questions

What is the IUPAC name of 2-(3-aminopropoxy)acetamide?
The IUPAC name of 2-(3-aminopropoxy)acetamide (CID 62344224) is 2-(3-aminopropoxy)acetamide.
What is the SMILES notation for 2-(3-aminopropoxy)acetamide?
The canonical SMILES for 2-(3-aminopropoxy)acetamide is NCCCOCC(N)=O.
What is the InChIKey of 2-(3-aminopropoxy)acetamide?
The InChIKey is UXKJTTFYGPSDIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2O2/c6-2-1-3-9-4-5(7)8/h1-4,6H2,(H2,7,8).
What are the key properties of 2-(3-aminopropoxy)acetamide?
2-(3-aminopropoxy)acetamide has a molecular weight of 132.16 g/mol, XLogP of -1.16, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-aminopropoxy)acetamide is sourced from PubChem (CID 62344224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).