N-(2-aminoethyl)-2-(oxan-4-yl)acetamide

C9H18N2O2 — CID 83617787

IUPACN-(2-aminoethyl)-2-(oxan-4-yl)acetamide
SMILESNCCNC(=O)CC1CCOCC1
InChIInChI=1S/C9H18N2O2/c10-3-4-11-9(12)7-8-1-5-13-6-2-8/h8H,1-7,10H2,(H,11,12)
InChIKeyVCVOFOAEOJZLTJ-UHFFFAOYSA-N
MW186.25 g/mol
LogP-0.12
Rot. Bonds4

About N-(2-aminoethyl)-2-(oxan-4-yl)acetamide

N-(2-aminoethyl)-2-(oxan-4-yl)acetamide (PubChem CID 83617787) has the molecular formula C9H18N2O2 and a molecular weight of 186.25 g/mol. Its IUPAC name is N-(2-aminoethyl)-2-(oxan-4-yl)acetamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-2-(oxan-4-yl)acetamide
PubChem CID83617787
Molecular FormulaC9H18N2O2
Molecular Weight186.25 g/mol
Exact Mass186.14
IUPAC NameN-(2-aminoethyl)-2-(oxan-4-yl)acetamide
SMILESNCCNC(=O)CC1CCOCC1
InChIInChI=1S/C9H18N2O2/c10-3-4-11-9(12)7-8-1-5-13-6-2-8/h8H,1-7,10H2,(H,11,12)
InChIKeyVCVOFOAEOJZLTJ-UHFFFAOYSA-N
XLogP-0.12
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 5-0.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(2-aminoethyl)-2-(oxan-4-yl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-2-(oxan-4-yl)acetamide?
The IUPAC name of N-(2-aminoethyl)-2-(oxan-4-yl)acetamide (CID 83617787) is N-(2-aminoethyl)-2-(oxan-4-yl)acetamide.
What is the SMILES notation for N-(2-aminoethyl)-2-(oxan-4-yl)acetamide?
The canonical SMILES for N-(2-aminoethyl)-2-(oxan-4-yl)acetamide is NCCNC(=O)CC1CCOCC1.
What is the InChIKey of N-(2-aminoethyl)-2-(oxan-4-yl)acetamide?
The InChIKey is VCVOFOAEOJZLTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O2/c10-3-4-11-9(12)7-8-1-5-13-6-2-8/h8H,1-7,10H2,(H,11,12).
What are the key properties of N-(2-aminoethyl)-2-(oxan-4-yl)acetamide?
N-(2-aminoethyl)-2-(oxan-4-yl)acetamide has a molecular weight of 186.25 g/mol, XLogP of -0.12, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-2-(oxan-4-yl)acetamide is sourced from PubChem (CID 83617787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).