N,N-diethyl-3-(N-phenylanilino)propanamide

C19H24N2O — CID 3040700

IUPACN,N-diethyl-3-(N-phenylanilino)propanamide
SMILESCCN(CC)C(=O)CCN(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H24N2O/c1-3-20(4-2)19(22)15-16-21(17-11-7-5-8-12-17)18-13-9-6-10-14-18/h5-14H,3-4,15-16H2,1-2H3
InChIKeyMELLVPTYXVCLMO-UHFFFAOYSA-N
MW296.41 g/mol
LogP4.08
Rot. Bonds7

About N,N-diethyl-3-(N-phenylanilino)propanamide

N,N-diethyl-3-(N-phenylanilino)propanamide (PubChem CID 3040700) has the molecular formula C19H24N2O and a molecular weight of 296.41 g/mol. Its IUPAC name is N,N-diethyl-3-(N-phenylanilino)propanamide.

Molecular Properties

Compound NameN,N-diethyl-3-(N-phenylanilino)propanamide
PubChem CID3040700
Molecular FormulaC19H24N2O
Molecular Weight296.41 g/mol
Exact Mass296.19
IUPAC NameN,N-diethyl-3-(N-phenylanilino)propanamide
SMILESCCN(CC)C(=O)CCN(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H24N2O/c1-3-20(4-2)19(22)15-16-21(17-11-7-5-8-12-17)18-13-9-6-10-14-18/h5-14H,3-4,15-16H2,1-2H3
InChIKeyMELLVPTYXVCLMO-UHFFFAOYSA-N
XLogP4.08
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 54.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-(N-benzylanilino)-N,N-diethylpropanamide
CID 109030661
3-[acetyl(benzyl)amino]-N,N-diethylpropanamide
CID 113118249
N,N-diethyl-4-oxo-4-phenylbutanamide
CID 10399096
3-[acetyl(2-phenylethyl)amino]-N,N-diethylpropanamide
CID 113120794
3-[benzyl(methylsulfonyl)amino]-N,N-diethylpropanamide
CID 113138656
N,N-diethyl-2-[2-oxo-2-(N-phenylanilino)ethoxy]acetamide
CID 51362044
3-[N-(diethylcarbamoyl)anilino]propanoic acid
CID 61186963
3-(N-methylsulfonylanilino)-N,N-dipropylpropanamide
CID 113141498
N-dodecyl-N-ethyl-3-phenylpropanamide
CID 91693976
2-(N-benzylanilino)-N,N-diethylacetamide
CID 109005016
N,N'-dibenzyl-N,N'-diethylpentanediamide
CID 68902262
N'-benzyl-N,N-diethyl-N'-phenylpropanediamide
CID 108951133

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-3-(N-phenylanilino)propanamide?
The IUPAC name of N,N-diethyl-3-(N-phenylanilino)propanamide (CID 3040700) is N,N-diethyl-3-(N-phenylanilino)propanamide.
What is the SMILES notation for N,N-diethyl-3-(N-phenylanilino)propanamide?
The canonical SMILES for N,N-diethyl-3-(N-phenylanilino)propanamide is CCN(CC)C(=O)CCN(c1ccccc1)c1ccccc1.
What is the InChIKey of N,N-diethyl-3-(N-phenylanilino)propanamide?
The InChIKey is MELLVPTYXVCLMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O/c1-3-20(4-2)19(22)15-16-21(17-11-7-5-8-12-17)18-13-9-6-10-14-18/h5-14H,3-4,15-16H2,1-2H3.
What are the key properties of N,N-diethyl-3-(N-phenylanilino)propanamide?
N,N-diethyl-3-(N-phenylanilino)propanamide has a molecular weight of 296.41 g/mol, XLogP of 4.08, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-3-(N-phenylanilino)propanamide is sourced from PubChem (CID 3040700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).