2-(N-acetylanilino)-N,N-dimethylacetamide

C12H16N2O2 — CID 19536

IUPAC2-(N-acetylanilino)-N,N-dimethylacetamide
SMILESCC(=O)N(CC(=O)N(C)C)c1ccccc1
InChIInChI=1S/C12H16N2O2/c1-10(15)14(9-12(16)13(2)3)11-7-5-4-6-8-11/h4-8H,9H2,1-3H3
InChIKeyKEVKBVWYVMVEBG-UHFFFAOYSA-N
MW220.27 g/mol
LogP1.13
Rot. Bonds3

About 2-(N-acetylanilino)-N,N-dimethylacetamide

2-(N-acetylanilino)-N,N-dimethylacetamide (PubChem CID 19536) has the molecular formula C12H16N2O2 and a molecular weight of 220.27 g/mol. Its IUPAC name is 2-(N-acetylanilino)-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-(N-acetylanilino)-N,N-dimethylacetamide
PubChem CID19536
Molecular FormulaC12H16N2O2
Molecular Weight220.27 g/mol
Exact Mass220.12
IUPAC Name2-(N-acetylanilino)-N,N-dimethylacetamide
SMILESCC(=O)N(CC(=O)N(C)C)c1ccccc1
InChIInChI=1S/C12H16N2O2/c1-10(15)14(9-12(16)13(2)3)11-7-5-4-6-8-11/h4-8H,9H2,1-3H3
InChIKeyKEVKBVWYVMVEBG-UHFFFAOYSA-N
XLogP1.13
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.27
LogP ≤ 51.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(N-acetylanilino)-N,N-dimethylacetamide?
The IUPAC name of 2-(N-acetylanilino)-N,N-dimethylacetamide (CID 19536) is 2-(N-acetylanilino)-N,N-dimethylacetamide.
What is the SMILES notation for 2-(N-acetylanilino)-N,N-dimethylacetamide?
The canonical SMILES for 2-(N-acetylanilino)-N,N-dimethylacetamide is CC(=O)N(CC(=O)N(C)C)c1ccccc1.
What is the InChIKey of 2-(N-acetylanilino)-N,N-dimethylacetamide?
The InChIKey is KEVKBVWYVMVEBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O2/c1-10(15)14(9-12(16)13(2)3)11-7-5-4-6-8-11/h4-8H,9H2,1-3H3.
What are the key properties of 2-(N-acetylanilino)-N,N-dimethylacetamide?
2-(N-acetylanilino)-N,N-dimethylacetamide has a molecular weight of 220.27 g/mol, XLogP of 1.13, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-acetylanilino)-N,N-dimethylacetamide is sourced from PubChem (CID 19536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).