2-(3,5-dihydroxyphenyl)-2-(ethylamino)propanamide

C11H16N2O3 — CID 107707485

IUPAC2-(3,5-dihydroxyphenyl)-2-(ethylamino)propanamide
SMILESCCNC(C)(C(N)=O)c1cc(O)cc(O)c1
InChIInChI=1S/C11H16N2O3/c1-3-13-11(2,10(12)16)7-4-8(14)6-9(15)5-7/h4-6,13-15H,3H2,1-2H3,(H2,12,16)
InChIKeyDHLCVJTVRQFUAG-UHFFFAOYSA-N
MW224.26 g/mol
LogP0.41
Rot. Bonds4

About 2-(3,5-dihydroxyphenyl)-2-(ethylamino)propanamide

2-(3,5-dihydroxyphenyl)-2-(ethylamino)propanamide (PubChem CID 107707485) has the molecular formula C11H16N2O3 and a molecular weight of 224.26 g/mol. Its IUPAC name is 2-(3,5-dihydroxyphenyl)-2-(ethylamino)propanamide.

Molecular Properties

Compound Name2-(3,5-dihydroxyphenyl)-2-(ethylamino)propanamide
PubChem CID107707485
Molecular FormulaC11H16N2O3
Molecular Weight224.26 g/mol
Exact Mass224.12
IUPAC Name2-(3,5-dihydroxyphenyl)-2-(ethylamino)propanamide
SMILESCCNC(C)(C(N)=O)c1cc(O)cc(O)c1
InChIInChI=1S/C11H16N2O3/c1-3-13-11(2,10(12)16)7-4-8(14)6-9(15)5-7/h4-6,13-15H,3H2,1-2H3,(H2,12,16)
InChIKeyDHLCVJTVRQFUAG-UHFFFAOYSA-N
XLogP0.41
TPSA95.58 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 50.41
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3,5-dihydroxyphenyl)-2-(propan-2-ylamino)propanamide
CID 107707483
2-(ethylamino)-2-(4-hydroxy-3-methoxyphenyl)propanamide
CID 60787205
2-(1,3-benzodioxol-5-yl)-2-(ethylamino)propanamide
CID 60786055
2-(cyclohexylamino)-2-(3,5-dihydroxyphenyl)propanamide
CID 107707551
ethyl 2-(3,5-dihydroxyphenyl)-2-(methylamino)propanoate
CID 107707487
2-(2,5-dichlorophenyl)-2-(ethylamino)propanamide
CID 60787377
2-(3,5-dihydroxyphenyl)-2-(methylamino)propanoic acid
CID 107707477
2-(4-bromo-2-chlorophenyl)-2-(ethylamino)propanamide
CID 82773747
methyl 3-(3,5-dihydroxyphenyl)-2-ethyl-3-hydroxybutanoate
CID 107707781
2-(4-bromophenyl)-2-(propylamino)propanamide
CID 60795515
(2R)-2-amino-2-(3,5-dihydroxyphenyl)propanoic acid
CID 55253702
2-(propylamino)-2-[3-(trifluoromethyl)phenyl]propanamide
CID 60796923

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dihydroxyphenyl)-2-(ethylamino)propanamide?
The IUPAC name of 2-(3,5-dihydroxyphenyl)-2-(ethylamino)propanamide (CID 107707485) is 2-(3,5-dihydroxyphenyl)-2-(ethylamino)propanamide.
What is the SMILES notation for 2-(3,5-dihydroxyphenyl)-2-(ethylamino)propanamide?
The canonical SMILES for 2-(3,5-dihydroxyphenyl)-2-(ethylamino)propanamide is CCNC(C)(C(N)=O)c1cc(O)cc(O)c1.
What is the InChIKey of 2-(3,5-dihydroxyphenyl)-2-(ethylamino)propanamide?
The InChIKey is DHLCVJTVRQFUAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O3/c1-3-13-11(2,10(12)16)7-4-8(14)6-9(15)5-7/h4-6,13-15H,3H2,1-2H3,(H2,12,16).
What are the key properties of 2-(3,5-dihydroxyphenyl)-2-(ethylamino)propanamide?
2-(3,5-dihydroxyphenyl)-2-(ethylamino)propanamide has a molecular weight of 224.26 g/mol, XLogP of 0.41, 4 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dihydroxyphenyl)-2-(ethylamino)propanamide is sourced from PubChem (CID 107707485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).