N-hydroxy-N',N'-diphenylpropanediamide

C15H14N2O3 — CID 3049610

IUPACN-hydroxy-N',N'-diphenylpropanediamide
SMILESO=C(CC(=O)N(c1ccccc1)c1ccccc1)NO
InChIInChI=1S/C15H14N2O3/c18-14(16-20)11-15(19)17(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,20H,11H2,(H,16,18)
InChIKeyRMOMHGUTSMSHDE-UHFFFAOYSA-N
MW270.29 g/mol
LogP2.25
Rot. Bonds4

About N-hydroxy-N',N'-diphenylpropanediamide

N-hydroxy-N',N'-diphenylpropanediamide (PubChem CID 3049610) has the molecular formula C15H14N2O3 and a molecular weight of 270.29 g/mol. Its IUPAC name is N-hydroxy-N',N'-diphenylpropanediamide.

Molecular Properties

Compound NameN-hydroxy-N',N'-diphenylpropanediamide
PubChem CID3049610
Molecular FormulaC15H14N2O3
Molecular Weight270.29 g/mol
Exact Mass270.10
IUPAC NameN-hydroxy-N',N'-diphenylpropanediamide
SMILESO=C(CC(=O)N(c1ccccc1)c1ccccc1)NO
InChIInChI=1S/C15H14N2O3/c18-14(16-20)11-15(19)17(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,20H,11H2,(H,16,18)
InChIKeyRMOMHGUTSMSHDE-UHFFFAOYSA-N
XLogP2.25
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.29
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-hydroxy-N',N'-diphenylpropanediamide?
The IUPAC name of N-hydroxy-N',N'-diphenylpropanediamide (CID 3049610) is N-hydroxy-N',N'-diphenylpropanediamide.
What is the SMILES notation for N-hydroxy-N',N'-diphenylpropanediamide?
The canonical SMILES for N-hydroxy-N',N'-diphenylpropanediamide is O=C(CC(=O)N(c1ccccc1)c1ccccc1)NO.
What is the InChIKey of N-hydroxy-N',N'-diphenylpropanediamide?
The InChIKey is RMOMHGUTSMSHDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O3/c18-14(16-20)11-15(19)17(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,20H,11H2,(H,16,18).
What are the key properties of N-hydroxy-N',N'-diphenylpropanediamide?
N-hydroxy-N',N'-diphenylpropanediamide has a molecular weight of 270.29 g/mol, XLogP of 2.25, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-N',N'-diphenylpropanediamide is sourced from PubChem (CID 3049610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).