ethane;N-methyl-2-[2-(methylamino)ethoxy]-N-propan-2-ylacetamide;molecular hydrogen

C11H28N2O2 — CID 177203747

IUPACethane;N-methyl-2-[2-(methylamino)ethoxy]-N-propan-2-ylacetamide;molecular hydrogen
SMILESCC.CNCCOCC(=O)N(C)C(C)C.[H][H]
InChIInChI=1S/C9H20N2O2.C2H6.H2/c1-8(2)11(4)9(12)7-13-6-5-10-3;1-2;/h8,10H,5-7H2,1-4H3;1-2H3;1H
InChIKeyHIXYFAIQZNBXAT-UHFFFAOYSA-N
MW220.36 g/mol
LogP1.36
Rot. Bonds6

About ethane;N-methyl-2-[2-(methylamino)ethoxy]-N-propan-2-ylacetamide;molecular hydrogen

ethane;N-methyl-2-[2-(methylamino)ethoxy]-N-propan-2-ylacetamide;molecular hydrogen (PubChem CID 177203747) has the molecular formula C11H28N2O2 and a molecular weight of 220.36 g/mol. Its IUPAC name is ethane;N-methyl-2-[2-(methylamino)ethoxy]-N-propan-2-ylacetamide;molecular hydrogen.

Molecular Properties

Compound Nameethane;N-methyl-2-[2-(methylamino)ethoxy]-N-propan-2-ylacetamide;molecular hydrogen
PubChem CID177203747
Molecular FormulaC11H28N2O2
Molecular Weight220.36 g/mol
Exact Mass220.22
IUPAC Nameethane;N-methyl-2-[2-(methylamino)ethoxy]-N-propan-2-ylacetamide;molecular hydrogen
SMILESCC.CNCCOCC(=O)N(C)C(C)C.[H][H]
InChIInChI=1S/C9H20N2O2.C2H6.H2/c1-8(2)11(4)9(12)7-13-6-5-10-3;1-2;/h8,10H,5-7H2,1-4H3;1-2H3;1H
InChIKeyHIXYFAIQZNBXAT-UHFFFAOYSA-N
XLogP1.36
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-methyl-2-[2-(methylamino)ethoxy]-N-[2-(2-methylsulfonylethoxy)ethyl]acetamide
CID 170359457
N-methyl-2-[2-(methylamino)ethoxy]acetamide
CID 54595045
N-methyl-N-[2-[2-[2-(methylamino)ethoxy]ethoxy]ethyl]-2-[methyl(propan-2-yl)amino]acetamide
CID 166694904
ethane;1-[2-[2-[2-(methylamino)ethoxy]ethoxy]ethoxy]propan-2-one
CID 155740359
N-methyl-2-[2-(methylamino)ethoxy]acetamide;hydrochloride
CID 54595044
2-[2-(methylamino)ethoxy]acetamide;hydrochloride
CID 90229092
N-methyl-2-[(2-methylpropan-2-yl)oxyamino]-N-propan-2-ylacetamide
CID 82723226
ethane;N-methyl-2-[2-[2-[2-(2-methylpropoxy)ethoxy]ethoxy]ethoxy]ethanamine;molecular hydrogen
CID 166117976
ethane;2-[2-[2-(methylamino)ethoxy]ethoxy]-N-(2-methylpropyl)acetamide
CID 153390370
2-chloro-N-methyl-N-propan-2-ylacetamide
CID 8899730
methyl 3-[methyl(propan-2-yl)amino]-3-oxopropanoate
CID 115174190
N-(1-hydroxypropan-2-yl)-2-(2-methoxyethoxy)-N-methylacetamide
CID 115765010

Frequently Asked Questions

What is the IUPAC name of ethane;N-methyl-2-[2-(methylamino)ethoxy]-N-propan-2-ylacetamide;molecular hydrogen?
The IUPAC name of ethane;N-methyl-2-[2-(methylamino)ethoxy]-N-propan-2-ylacetamide;molecular hydrogen (CID 177203747) is ethane;N-methyl-2-[2-(methylamino)ethoxy]-N-propan-2-ylacetamide;molecular hydrogen.
What is the SMILES notation for ethane;N-methyl-2-[2-(methylamino)ethoxy]-N-propan-2-ylacetamide;molecular hydrogen?
The canonical SMILES for ethane;N-methyl-2-[2-(methylamino)ethoxy]-N-propan-2-ylacetamide;molecular hydrogen is CC.CNCCOCC(=O)N(C)C(C)C.[H][H].
What is the InChIKey of ethane;N-methyl-2-[2-(methylamino)ethoxy]-N-propan-2-ylacetamide;molecular hydrogen?
The InChIKey is HIXYFAIQZNBXAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O2.C2H6.H2/c1-8(2)11(4)9(12)7-13-6-5-10-3;1-2;/h8,10H,5-7H2,1-4H3;1-2H3;1H.
What are the key properties of ethane;N-methyl-2-[2-(methylamino)ethoxy]-N-propan-2-ylacetamide;molecular hydrogen?
ethane;N-methyl-2-[2-(methylamino)ethoxy]-N-propan-2-ylacetamide;molecular hydrogen has a molecular weight of 220.36 g/mol, XLogP of 1.36, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-methyl-2-[2-(methylamino)ethoxy]-N-propan-2-ylacetamide;molecular hydrogen is sourced from PubChem (CID 177203747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).