3-amino-N-[2-[2-(diethylamino)ethoxy]phenyl]propanamide;dihydrochloride

C15H27Cl2N3O2 — CID 119841506

IUPAC3-amino-N-[2-[2-(diethylamino)ethoxy]phenyl]propanamide;dihydrochloride
SMILESCCN(CC)CCOc1ccccc1NC(=O)CCN.Cl.Cl
InChIInChI=1S/C15H25N3O2.2ClH/c1-3-18(4-2)11-12-20-14-8-6-5-7-13(14)17-15(19)9-10-16;;/h5-8H,3-4,9-12,16H2,1-2H3,(H,17,19);2*1H
InChIKeySSWSWAIYBJHMKY-UHFFFAOYSA-N
MW352.31 g/mol
LogP2.54
Rot. Bonds9

About 3-amino-N-[2-[2-(diethylamino)ethoxy]phenyl]propanamide;dihydrochloride

3-amino-N-[2-[2-(diethylamino)ethoxy]phenyl]propanamide;dihydrochloride (PubChem CID 119841506) has the molecular formula C15H27Cl2N3O2 and a molecular weight of 352.31 g/mol. Its IUPAC name is 3-amino-N-[2-[2-(diethylamino)ethoxy]phenyl]propanamide;dihydrochloride.

Molecular Properties

Compound Name3-amino-N-[2-[2-(diethylamino)ethoxy]phenyl]propanamide;dihydrochloride
PubChem CID119841506
Molecular FormulaC15H27Cl2N3O2
Molecular Weight352.31 g/mol
Exact Mass351.15
IUPAC Name3-amino-N-[2-[2-(diethylamino)ethoxy]phenyl]propanamide;dihydrochloride
SMILESCCN(CC)CCOc1ccccc1NC(=O)CCN.Cl.Cl
InChIInChI=1S/C15H25N3O2.2ClH/c1-3-18(4-2)11-12-20-14-8-6-5-7-13(14)17-15(19)9-10-16;;/h5-8H,3-4,9-12,16H2,1-2H3,(H,17,19);2*1H
InChIKeySSWSWAIYBJHMKY-UHFFFAOYSA-N
XLogP2.54
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.31
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-[2-(diethylamino)ethoxy]phenyl]pentanamide
CID 71898997
3-amino-N-(2-propoxyphenyl)propanamide;hydrochloride
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3-amino-N-(2-ethoxyphenyl)propanamide;hydrochloride
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3-amino-N-[2-[2-(diethylamino)ethoxy]phenyl]-3-phenylpropanamide;dihydrochloride
CID 119952938
N-[2-[2-(diethylamino)ethoxy]phenyl]-3-(2,4-dimethylphenoxy)propanamide
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N-[2-[2-(diethylamino)ethoxy]phenyl]-4-(3-fluorophenoxy)butanamide
CID 55965654
3-[[benzyl(methyl)carbamoyl]amino]-N-[2-[2-(diethylamino)ethoxy]phenyl]propanamide
CID 56514095
N-[2-[2-(diethylamino)ethoxy]phenyl]-3-(1,3,5-trimethylpyrazol-4-yl)propanamide
CID 55538702
2-(3,4-dichlorophenyl)-N-[2-[2-(diethylamino)ethoxy]phenyl]acetamide
CID 17499285
4-amino-N-(2-ethoxyphenyl)butanamide;hydrochloride
CID 119263924
N,N'-bis(2-butoxyphenyl)hexanediamide
CID 17087317
2-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-N-[2-[2-(diethylamino)ethoxy]phenyl]acetamide
CID 55538487

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[2-[2-(diethylamino)ethoxy]phenyl]propanamide;dihydrochloride?
The IUPAC name of 3-amino-N-[2-[2-(diethylamino)ethoxy]phenyl]propanamide;dihydrochloride (CID 119841506) is 3-amino-N-[2-[2-(diethylamino)ethoxy]phenyl]propanamide;dihydrochloride.
What is the SMILES notation for 3-amino-N-[2-[2-(diethylamino)ethoxy]phenyl]propanamide;dihydrochloride?
The canonical SMILES for 3-amino-N-[2-[2-(diethylamino)ethoxy]phenyl]propanamide;dihydrochloride is CCN(CC)CCOc1ccccc1NC(=O)CCN.Cl.Cl.
What is the InChIKey of 3-amino-N-[2-[2-(diethylamino)ethoxy]phenyl]propanamide;dihydrochloride?
The InChIKey is SSWSWAIYBJHMKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2.2ClH/c1-3-18(4-2)11-12-20-14-8-6-5-7-13(14)17-15(19)9-10-16;;/h5-8H,3-4,9-12,16H2,1-2H3,(H,17,19);2*1H.
What are the key properties of 3-amino-N-[2-[2-(diethylamino)ethoxy]phenyl]propanamide;dihydrochloride?
3-amino-N-[2-[2-(diethylamino)ethoxy]phenyl]propanamide;dihydrochloride has a molecular weight of 352.31 g/mol, XLogP of 2.54, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[2-[2-(diethylamino)ethoxy]phenyl]propanamide;dihydrochloride is sourced from PubChem (CID 119841506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).