2-[2,2-dimethoxyethyl(propyl)amino]-N,N-dimethylacetamide

C11H24N2O3 — CID 66221703

IUPAC2-[2,2-dimethoxyethyl(propyl)amino]-N,N-dimethylacetamide
SMILESCCCN(CC(=O)N(C)C)CC(OC)OC
InChIInChI=1S/C11H24N2O3/c1-6-7-13(8-10(14)12(2)3)9-11(15-4)16-5/h11H,6-9H2,1-5H3
InChIKeyJSWVUYPTKXNKTI-UHFFFAOYSA-N
MW232.32 g/mol
LogP0.41
Rot. Bonds8

About 2-[2,2-dimethoxyethyl(propyl)amino]-N,N-dimethylacetamide

2-[2,2-dimethoxyethyl(propyl)amino]-N,N-dimethylacetamide (PubChem CID 66221703) has the molecular formula C11H24N2O3 and a molecular weight of 232.32 g/mol. Its IUPAC name is 2-[2,2-dimethoxyethyl(propyl)amino]-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-[2,2-dimethoxyethyl(propyl)amino]-N,N-dimethylacetamide
PubChem CID66221703
Molecular FormulaC11H24N2O3
Molecular Weight232.32 g/mol
Exact Mass232.18
IUPAC Name2-[2,2-dimethoxyethyl(propyl)amino]-N,N-dimethylacetamide
SMILESCCCN(CC(=O)N(C)C)CC(OC)OC
InChIInChI=1S/C11H24N2O3/c1-6-7-13(8-10(14)12(2)3)9-11(15-4)16-5/h11H,6-9H2,1-5H3
InChIKeyJSWVUYPTKXNKTI-UHFFFAOYSA-N
XLogP0.41
TPSA42.01 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.32
LogP ≤ 50.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[2,2-dimethoxyethyl(propyl)amino]-N,N-dimethylacetamide?
The IUPAC name of 2-[2,2-dimethoxyethyl(propyl)amino]-N,N-dimethylacetamide (CID 66221703) is 2-[2,2-dimethoxyethyl(propyl)amino]-N,N-dimethylacetamide.
What is the SMILES notation for 2-[2,2-dimethoxyethyl(propyl)amino]-N,N-dimethylacetamide?
The canonical SMILES for 2-[2,2-dimethoxyethyl(propyl)amino]-N,N-dimethylacetamide is CCCN(CC(=O)N(C)C)CC(OC)OC.
What is the InChIKey of 2-[2,2-dimethoxyethyl(propyl)amino]-N,N-dimethylacetamide?
The InChIKey is JSWVUYPTKXNKTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O3/c1-6-7-13(8-10(14)12(2)3)9-11(15-4)16-5/h11H,6-9H2,1-5H3.
What are the key properties of 2-[2,2-dimethoxyethyl(propyl)amino]-N,N-dimethylacetamide?
2-[2,2-dimethoxyethyl(propyl)amino]-N,N-dimethylacetamide has a molecular weight of 232.32 g/mol, XLogP of 0.41, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2,2-dimethoxyethyl(propyl)amino]-N,N-dimethylacetamide is sourced from PubChem (CID 66221703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).