2-anilino-N,N-diethylacetamide;hydrochloride

C12H19ClN2O — CID 119671427

IUPAC2-anilino-N,N-diethylacetamide;hydrochloride
SMILESCCN(CC)C(=O)CNc1ccccc1.Cl
InChIInChI=1S/C12H18N2O.ClH/c1-3-14(4-2)12(15)10-13-11-8-6-5-7-9-11;/h5-9,13H,3-4,10H2,1-2H3;1H
InChIKeyUHQPEMWAWPDHOU-UHFFFAOYSA-N
MW242.75 g/mol
LogP2.39
Rot. Bonds5

About 2-anilino-N,N-diethylacetamide;hydrochloride

2-anilino-N,N-diethylacetamide;hydrochloride (PubChem CID 119671427) has the molecular formula C12H19ClN2O and a molecular weight of 242.75 g/mol. Its IUPAC name is 2-anilino-N,N-diethylacetamide;hydrochloride.

Molecular Properties

Compound Name2-anilino-N,N-diethylacetamide;hydrochloride
PubChem CID119671427
Molecular FormulaC12H19ClN2O
Molecular Weight242.75 g/mol
Exact Mass242.12
IUPAC Name2-anilino-N,N-diethylacetamide;hydrochloride
SMILESCCN(CC)C(=O)CNc1ccccc1.Cl
InChIInChI=1S/C12H18N2O.ClH/c1-3-14(4-2)12(15)10-13-11-8-6-5-7-9-11;/h5-9,13H,3-4,10H2,1-2H3;1H
InChIKeyUHQPEMWAWPDHOU-UHFFFAOYSA-N
XLogP2.39
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.75
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-anilino-N-ethyl-N-(2-hydroxyethyl)acetamide
CID 60945484
2-anilino-N-ethyl-N-(2-phenylethyl)acetamide
CID 60946372
N,N-diethyl-2-(4-hydroxyanilino)acetamide
CID 11806273
2-anilino-N-ethyl-N-(pyridin-4-ylmethyl)acetamide
CID 60962477
2-anilino-N-benzyl-N-propylacetamide;hydrochloride
CID 119681623
2-(3-chloroanilino)-N,N-diethylacetamide
CID 28580548
N,N-bis(2-amino-2-oxoethyl)-2-anilinoacetamide
CID 55155300
2-anilino-N-butyl-N-(2-hydroxyethyl)acetamide
CID 54870892
N,N-diethyl-2-(3-ethynylanilino)acetamide
CID 28564060
N,N-diethyl-2-[3-(trifluoromethyl)anilino]acetamide
CID 28571798
N-[3-[[2-(diethylamino)-2-oxoethyl]amino]phenyl]-2,2-dimethylpropanamide
CID 54836795
2-(3,5-dimethylanilino)-N,N-diethylacetamide
CID 28582869

Frequently Asked Questions

What is the IUPAC name of 2-anilino-N,N-diethylacetamide;hydrochloride?
The IUPAC name of 2-anilino-N,N-diethylacetamide;hydrochloride (CID 119671427) is 2-anilino-N,N-diethylacetamide;hydrochloride.
What is the SMILES notation for 2-anilino-N,N-diethylacetamide;hydrochloride?
The canonical SMILES for 2-anilino-N,N-diethylacetamide;hydrochloride is CCN(CC)C(=O)CNc1ccccc1.Cl.
What is the InChIKey of 2-anilino-N,N-diethylacetamide;hydrochloride?
The InChIKey is UHQPEMWAWPDHOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O.ClH/c1-3-14(4-2)12(15)10-13-11-8-6-5-7-9-11;/h5-9,13H,3-4,10H2,1-2H3;1H.
What are the key properties of 2-anilino-N,N-diethylacetamide;hydrochloride?
2-anilino-N,N-diethylacetamide;hydrochloride has a molecular weight of 242.75 g/mol, XLogP of 2.39, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-anilino-N,N-diethylacetamide;hydrochloride is sourced from PubChem (CID 119671427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).