N,3-dihydroxy-3-(4-methoxyphenyl)propanamide

C10H13NO4 — CID 72707665

IUPACN,3-dihydroxy-3-(4-methoxyphenyl)propanamide
SMILESCOc1ccc(C(O)CC(=O)NO)cc1
InChIInChI=1S/C10H13NO4/c1-15-8-4-2-7(3-5-8)9(12)6-10(13)11-14/h2-5,9,12,14H,6H2,1H3,(H,11,13)
InChIKeyOPODPBQULVPNHN-UHFFFAOYSA-N
MW211.22 g/mol
LogP0.62
Rot. Bonds4

About N,3-dihydroxy-3-(4-methoxyphenyl)propanamide

N,3-dihydroxy-3-(4-methoxyphenyl)propanamide (PubChem CID 72707665) has the molecular formula C10H13NO4 and a molecular weight of 211.22 g/mol. Its IUPAC name is N,3-dihydroxy-3-(4-methoxyphenyl)propanamide.

Molecular Properties

Compound NameN,3-dihydroxy-3-(4-methoxyphenyl)propanamide
PubChem CID72707665
Molecular FormulaC10H13NO4
Molecular Weight211.22 g/mol
Exact Mass211.08
IUPAC NameN,3-dihydroxy-3-(4-methoxyphenyl)propanamide
SMILESCOc1ccc(C(O)CC(=O)NO)cc1
InChIInChI=1S/C10H13NO4/c1-15-8-4-2-7(3-5-8)9(12)6-10(13)11-14/h2-5,9,12,14H,6H2,1H3,(H,11,13)
InChIKeyOPODPBQULVPNHN-UHFFFAOYSA-N
XLogP0.62
TPSA78.79 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.22
LogP ≤ 50.62
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

Bufexamac
CID 2466
Acetohydroxamic acid, (p-propoxy)phenyl-
CID 25922
N-hydroxy-2-(4-methoxyphenyl)acetamide
CID 12814959
2-(4-ethoxyphenyl)-N-hydroxyacetamide
CID 4589721
2-(4-butan-2-yloxyphenyl)-N-hydroxyacetamide
CID 54758532
3-Hydroxy-3-(3-methoxyphenyl)propanamide
CID 660756
N-hydroxy-3-(4-methoxyphenyl)propanamide
CID 12814960
2-Amino-3-hydroxy-3-(4-methoxyphenyl)propanoic acid
CID 15594562
N,3-dihydroxy-3-(2-methoxyphenyl)propanamide
CID 72707598
N,3-dihydroxy-3-(3-methoxyphenyl)propanamide
CID 72707602
N,3-dihydroxy-3-(4-phenylmethoxyphenyl)propanamide
CID 72707666
3-(5-fluoro-2-methoxyphenyl)-N,3-dihydroxypropanamide
CID 72707673

Frequently Asked Questions

What is the IUPAC name of N,3-dihydroxy-3-(4-methoxyphenyl)propanamide?
The IUPAC name of N,3-dihydroxy-3-(4-methoxyphenyl)propanamide (CID 72707665) is N,3-dihydroxy-3-(4-methoxyphenyl)propanamide.
What is the SMILES notation for N,3-dihydroxy-3-(4-methoxyphenyl)propanamide?
The canonical SMILES for N,3-dihydroxy-3-(4-methoxyphenyl)propanamide is COc1ccc(C(O)CC(=O)NO)cc1.
What is the InChIKey of N,3-dihydroxy-3-(4-methoxyphenyl)propanamide?
The InChIKey is OPODPBQULVPNHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO4/c1-15-8-4-2-7(3-5-8)9(12)6-10(13)11-14/h2-5,9,12,14H,6H2,1H3,(H,11,13).
What are the key properties of N,3-dihydroxy-3-(4-methoxyphenyl)propanamide?
N,3-dihydroxy-3-(4-methoxyphenyl)propanamide has a molecular weight of 211.22 g/mol, XLogP of 0.62, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-dihydroxy-3-(4-methoxyphenyl)propanamide is sourced from PubChem (CID 72707665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).