N-[2-[acetyl(methyl)amino]ethyl]-N-methylacetamide

C8H16N2O2 — CID 12807949

IUPACN-[2-[acetyl(methyl)amino]ethyl]-N-methylacetamide
SMILESCC(=O)N(C)CCN(C)C(C)=O
InChIInChI=1S/C8H16N2O2/c1-7(11)9(3)5-6-10(4)8(2)12/h5-6H2,1-4H3
InChIKeyTYJXKGNJOSVQCP-UHFFFAOYSA-N
MW172.23 g/mol
LogP-0.06
Rot. Bonds3

About N-[2-[acetyl(methyl)amino]ethyl]-N-methylacetamide

N-[2-[acetyl(methyl)amino]ethyl]-N-methylacetamide (PubChem CID 12807949) has the molecular formula C8H16N2O2 and a molecular weight of 172.23 g/mol. Its IUPAC name is N-[2-[acetyl(methyl)amino]ethyl]-N-methylacetamide.

Molecular Properties

Compound NameN-[2-[acetyl(methyl)amino]ethyl]-N-methylacetamide
PubChem CID12807949
Molecular FormulaC8H16N2O2
Molecular Weight172.23 g/mol
Exact Mass172.12
IUPAC NameN-[2-[acetyl(methyl)amino]ethyl]-N-methylacetamide
SMILESCC(=O)N(C)CCN(C)C(C)=O
InChIInChI=1S/C8H16N2O2/c1-7(11)9(3)5-6-10(4)8(2)12/h5-6H2,1-4H3
InChIKeyTYJXKGNJOSVQCP-UHFFFAOYSA-N
XLogP-0.06
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.23
LogP ≤ 5-0.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[2-[acetyl(methyl)amino]ethyl]-N-methylacetamide?
The IUPAC name of N-[2-[acetyl(methyl)amino]ethyl]-N-methylacetamide (CID 12807949) is N-[2-[acetyl(methyl)amino]ethyl]-N-methylacetamide.
What is the SMILES notation for N-[2-[acetyl(methyl)amino]ethyl]-N-methylacetamide?
The canonical SMILES for N-[2-[acetyl(methyl)amino]ethyl]-N-methylacetamide is CC(=O)N(C)CCN(C)C(C)=O.
What is the InChIKey of N-[2-[acetyl(methyl)amino]ethyl]-N-methylacetamide?
The InChIKey is TYJXKGNJOSVQCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O2/c1-7(11)9(3)5-6-10(4)8(2)12/h5-6H2,1-4H3.
What are the key properties of N-[2-[acetyl(methyl)amino]ethyl]-N-methylacetamide?
N-[2-[acetyl(methyl)amino]ethyl]-N-methylacetamide has a molecular weight of 172.23 g/mol, XLogP of -0.06, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[acetyl(methyl)amino]ethyl]-N-methylacetamide is sourced from PubChem (CID 12807949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).