2-[2-(diethylamino)ethylamino]-2-(4-ethylphenyl)propanamide

C17H29N3O — CID 60995324

IUPAC2-[2-(diethylamino)ethylamino]-2-(4-ethylphenyl)propanamide
SMILESCCc1ccc(C(C)(NCCN(CC)CC)C(N)=O)cc1
InChIInChI=1S/C17H29N3O/c1-5-14-8-10-15(11-9-14)17(4,16(18)21)19-12-13-20(6-2)7-3/h8-11,19H,5-7,12-13H2,1-4H3,(H2,18,21)
InChIKeyOGHPWCFOTORKRI-UHFFFAOYSA-N
MW291.44 g/mol
LogP1.88
Rot. Bonds9

About 2-[2-(diethylamino)ethylamino]-2-(4-ethylphenyl)propanamide

2-[2-(diethylamino)ethylamino]-2-(4-ethylphenyl)propanamide (PubChem CID 60995324) has the molecular formula C17H29N3O and a molecular weight of 291.44 g/mol. Its IUPAC name is 2-[2-(diethylamino)ethylamino]-2-(4-ethylphenyl)propanamide.

Molecular Properties

Compound Name2-[2-(diethylamino)ethylamino]-2-(4-ethylphenyl)propanamide
PubChem CID60995324
Molecular FormulaC17H29N3O
Molecular Weight291.44 g/mol
Exact Mass291.23
IUPAC Name2-[2-(diethylamino)ethylamino]-2-(4-ethylphenyl)propanamide
SMILESCCc1ccc(C(C)(NCCN(CC)CC)C(N)=O)cc1
InChIInChI=1S/C17H29N3O/c1-5-14-8-10-15(11-9-14)17(4,16(18)21)19-12-13-20(6-2)7-3/h8-11,19H,5-7,12-13H2,1-4H3,(H2,18,21)
InChIKeyOGHPWCFOTORKRI-UHFFFAOYSA-N
XLogP1.88
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.44
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-ethylphenyl)-2-(2-methylpropylamino)propanamide
CID 54891464
2-[2-(diethylamino)ethylamino]-2-(4-methylphenyl)propanoic acid
CID 60994645
2-[2-(diethylamino)ethylamino]-2-(2,5-dimethylphenyl)propanamide
CID 60995327
2-[2-(diethylamino)ethylamino]-2-(2-fluorophenyl)propanamide
CID 60995482
2-[2-(dimethylamino)ethylamino]-2-[4-(dimethylamino)phenyl]propanamide
CID 60995360
2-(4-bromophenyl)-2-[2-(dimethylamino)ethylamino]propanamide
CID 54891318
2-[2-(diethylamino)ethylamino]-2-(4-methoxyphenyl)propanoic acid
CID 60994370
2-[2-(diethylamino)ethylamino]-2-(2-methoxyphenyl)propanamide
CID 60995329
2-[2-(dimethylamino)ethylamino]-2-(4-ethoxyphenyl)propanamide
CID 60991163
2-[2-(diethylamino)ethylamino]-2-(4-hydroxyphenyl)butanamide
CID 60997030
2-(5-bromo-2-fluorophenyl)-2-[2-(diethylamino)ethylamino]propanamide
CID 82953788
2-(4-bromophenyl)-2-(propylamino)propanamide
CID 60795515

Frequently Asked Questions

What is the IUPAC name of 2-[2-(diethylamino)ethylamino]-2-(4-ethylphenyl)propanamide?
The IUPAC name of 2-[2-(diethylamino)ethylamino]-2-(4-ethylphenyl)propanamide (CID 60995324) is 2-[2-(diethylamino)ethylamino]-2-(4-ethylphenyl)propanamide.
What is the SMILES notation for 2-[2-(diethylamino)ethylamino]-2-(4-ethylphenyl)propanamide?
The canonical SMILES for 2-[2-(diethylamino)ethylamino]-2-(4-ethylphenyl)propanamide is CCc1ccc(C(C)(NCCN(CC)CC)C(N)=O)cc1.
What is the InChIKey of 2-[2-(diethylamino)ethylamino]-2-(4-ethylphenyl)propanamide?
The InChIKey is OGHPWCFOTORKRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N3O/c1-5-14-8-10-15(11-9-14)17(4,16(18)21)19-12-13-20(6-2)7-3/h8-11,19H,5-7,12-13H2,1-4H3,(H2,18,21).
What are the key properties of 2-[2-(diethylamino)ethylamino]-2-(4-ethylphenyl)propanamide?
2-[2-(diethylamino)ethylamino]-2-(4-ethylphenyl)propanamide has a molecular weight of 291.44 g/mol, XLogP of 1.88, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(diethylamino)ethylamino]-2-(4-ethylphenyl)propanamide is sourced from PubChem (CID 60995324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).