N,N-diethyl-2-(N-propanoylanilino)propanamide

C16H24N2O2 — CID 3022090

IUPACN,N-diethyl-2-(N-propanoylanilino)propanamide
SMILESCCC(=O)N(c1ccccc1)C(C)C(=O)N(CC)CC
InChIInChI=1S/C16H24N2O2/c1-5-15(19)18(14-11-9-8-10-12-14)13(4)16(20)17(6-2)7-3/h8-13H,5-7H2,1-4H3
InChIKeyIVLVENGKFIEGPY-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.69
Rot. Bonds6

About N,N-diethyl-2-(N-propanoylanilino)propanamide

N,N-diethyl-2-(N-propanoylanilino)propanamide (PubChem CID 3022090) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N,N-diethyl-2-(N-propanoylanilino)propanamide.

Molecular Properties

Compound NameN,N-diethyl-2-(N-propanoylanilino)propanamide
PubChem CID3022090
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC NameN,N-diethyl-2-(N-propanoylanilino)propanamide
SMILESCCC(=O)N(c1ccccc1)C(C)C(=O)N(CC)CC
InChIInChI=1S/C16H24N2O2/c1-5-15(19)18(14-11-9-8-10-12-14)13(4)16(20)17(6-2)7-3/h8-13H,5-7H2,1-4H3
InChIKeyIVLVENGKFIEGPY-UHFFFAOYSA-N
XLogP2.69
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-(N-propanoylanilino)propanamide?
The IUPAC name of N,N-diethyl-2-(N-propanoylanilino)propanamide (CID 3022090) is N,N-diethyl-2-(N-propanoylanilino)propanamide.
What is the SMILES notation for N,N-diethyl-2-(N-propanoylanilino)propanamide?
The canonical SMILES for N,N-diethyl-2-(N-propanoylanilino)propanamide is CCC(=O)N(c1ccccc1)C(C)C(=O)N(CC)CC.
What is the InChIKey of N,N-diethyl-2-(N-propanoylanilino)propanamide?
The InChIKey is IVLVENGKFIEGPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-5-15(19)18(14-11-9-8-10-12-14)13(4)16(20)17(6-2)7-3/h8-13H,5-7H2,1-4H3.
What are the key properties of N,N-diethyl-2-(N-propanoylanilino)propanamide?
N,N-diethyl-2-(N-propanoylanilino)propanamide has a molecular weight of 276.38 g/mol, XLogP of 2.69, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-(N-propanoylanilino)propanamide is sourced from PubChem (CID 3022090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).