3-anilino-N,N-dimethylpropanamide

C11H16N2O — CID 60961994

IUPAC3-anilino-N,N-dimethylpropanamide
SMILESCN(C)C(=O)CCNc1ccccc1
InChIInChI=1S/C11H16N2O/c1-13(2)11(14)8-9-12-10-6-4-3-5-7-10/h3-7,12H,8-9H2,1-2H3
InChIKeyPXFJKTICJZHLNW-UHFFFAOYSA-N
MW192.26 g/mol
LogP1.58
Rot. Bonds4

About 3-anilino-N,N-dimethylpropanamide

3-anilino-N,N-dimethylpropanamide (PubChem CID 60961994) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 3-anilino-N,N-dimethylpropanamide.

Molecular Properties

Compound Name3-anilino-N,N-dimethylpropanamide
PubChem CID60961994
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name3-anilino-N,N-dimethylpropanamide
SMILESCN(C)C(=O)CCNc1ccccc1
InChIInChI=1S/C11H16N2O/c1-13(2)11(14)8-9-12-10-6-4-3-5-7-10/h3-7,12H,8-9H2,1-2H3
InChIKeyPXFJKTICJZHLNW-UHFFFAOYSA-N
XLogP1.58
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-[[3-(dimethylamino)-3-oxopropyl]amino]benzoic acid
CID 62230699
N,N-dimethyl-3-(3-phenoxyanilino)propanamide
CID 61367393
3-(4-tert-butylanilino)-N,N-dimethylpropanamide
CID 54879290
3-(4-chloroanilino)-N,N-dimethylpropanamide
CID 60960793
3-(4-acetamidoanilino)-N,N-dimethylpropanamide
CID 54879243
3-(4-acetylanilino)-N,N-dimethylpropanamide
CID 114468155
3-[4-(dimethylsulfamoyl)anilino]-N,N-dimethylpropanamide
CID 60926501
3-(2-anilinoethyl)-1,1-dimethylurea
CID 142040993
3-(2-ethylanilino)-N,N-dimethylpropanamide
CID 60961204
5-[[3-(dimethylamino)-3-oxopropyl]amino]pyridine-2-carboxylic acid
CID 104638856
ethyl 3-anilinopropanoate
CID 10910393
2-[anilinomethyl(methyl)amino]-N,N-dimethylacetamide
CID 141036638

Frequently Asked Questions

What is the IUPAC name of 3-anilino-N,N-dimethylpropanamide?
The IUPAC name of 3-anilino-N,N-dimethylpropanamide (CID 60961994) is 3-anilino-N,N-dimethylpropanamide.
What is the SMILES notation for 3-anilino-N,N-dimethylpropanamide?
The canonical SMILES for 3-anilino-N,N-dimethylpropanamide is CN(C)C(=O)CCNc1ccccc1.
What is the InChIKey of 3-anilino-N,N-dimethylpropanamide?
The InChIKey is PXFJKTICJZHLNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-13(2)11(14)8-9-12-10-6-4-3-5-7-10/h3-7,12H,8-9H2,1-2H3.
What are the key properties of 3-anilino-N,N-dimethylpropanamide?
3-anilino-N,N-dimethylpropanamide has a molecular weight of 192.26 g/mol, XLogP of 1.58, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-anilino-N,N-dimethylpropanamide is sourced from PubChem (CID 60961994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).