N-[2-(4-hydroxyanilino)-2-oxoethyl]propanamide

C11H14N2O3 — CID 59961348

IUPACN-[2-(4-hydroxyanilino)-2-oxoethyl]propanamide
SMILESCCC(=O)NCC(=O)Nc1ccc(O)cc1
InChIInChI=1S/C11H14N2O3/c1-2-10(15)12-7-11(16)13-8-3-5-9(14)6-4-8/h3-6,14H,2,7H2,1H3,(H,12,15)(H,13,16)
InChIKeyZRYYCVVZUKCHEB-UHFFFAOYSA-N
MW222.24 g/mol
LogP0.86
Rot. Bonds4

About N-[2-(4-hydroxyanilino)-2-oxoethyl]propanamide

N-[2-(4-hydroxyanilino)-2-oxoethyl]propanamide (PubChem CID 59961348) has the molecular formula C11H14N2O3 and a molecular weight of 222.24 g/mol. Its IUPAC name is N-[2-(4-hydroxyanilino)-2-oxoethyl]propanamide.

Molecular Properties

Compound NameN-[2-(4-hydroxyanilino)-2-oxoethyl]propanamide
PubChem CID59961348
Molecular FormulaC11H14N2O3
Molecular Weight222.24 g/mol
Exact Mass222.10
IUPAC NameN-[2-(4-hydroxyanilino)-2-oxoethyl]propanamide
SMILESCCC(=O)NCC(=O)Nc1ccc(O)cc1
InChIInChI=1S/C11H14N2O3/c1-2-10(15)12-7-11(16)13-8-3-5-9(14)6-4-8/h3-6,14H,2,7H2,1H3,(H,12,15)(H,13,16)
InChIKeyZRYYCVVZUKCHEB-UHFFFAOYSA-N
XLogP0.86
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.24
LogP ≤ 50.86
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroquinone', 'substructure': 'N/A'}

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Related Compounds

N-[2-(4-hydroxyanilino)-2-oxoethyl]heptanamide
CID 22082464
3,3-dimethyl-N-[2-oxo-2-[4-(propanoylamino)anilino]ethyl]butanamide
CID 51091817
N-[2-oxo-2-(4-propan-2-yloxyanilino)ethyl]propanamide
CID 47415261
N-[2-[4-(4,5-dimethylimidazol-1-yl)anilino]-2-oxoethyl]propanamide
CID 166215458
2-(4-hydroxyphenyl)-N-[2-(4-methoxyanilino)-2-oxoethyl]acetamide
CID 122191191
N-benzyl-4-[[2-(propanoylamino)acetyl]amino]benzamide
CID 86846187
N-[2-(3-bromoanilino)-2-oxoethyl]propanamide
CID 113000509
N-(4-hydroxyphenyl)-2-triethylsilylacetamide
CID 101420020
N-[4-[[2-(propylamino)acetyl]amino]phenyl]propanamide
CID 54818859
N-(4-hydroxyphenyl)-3-methylbutanamide
CID 836029
N-[4-[(2-aminoacetyl)amino]phenyl]propanamide
CID 43708679
methyl 2-[[4-(propanoylamino)benzoyl]amino]acetate
CID 2985304

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-hydroxyanilino)-2-oxoethyl]propanamide?
The IUPAC name of N-[2-(4-hydroxyanilino)-2-oxoethyl]propanamide (CID 59961348) is N-[2-(4-hydroxyanilino)-2-oxoethyl]propanamide.
What is the SMILES notation for N-[2-(4-hydroxyanilino)-2-oxoethyl]propanamide?
The canonical SMILES for N-[2-(4-hydroxyanilino)-2-oxoethyl]propanamide is CCC(=O)NCC(=O)Nc1ccc(O)cc1.
What is the InChIKey of N-[2-(4-hydroxyanilino)-2-oxoethyl]propanamide?
The InChIKey is ZRYYCVVZUKCHEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O3/c1-2-10(15)12-7-11(16)13-8-3-5-9(14)6-4-8/h3-6,14H,2,7H2,1H3,(H,12,15)(H,13,16).
What are the key properties of N-[2-(4-hydroxyanilino)-2-oxoethyl]propanamide?
N-[2-(4-hydroxyanilino)-2-oxoethyl]propanamide has a molecular weight of 222.24 g/mol, XLogP of 0.86, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-hydroxyanilino)-2-oxoethyl]propanamide is sourced from PubChem (CID 59961348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).