N-hydroxy-2-[3-[3-(2-oxopyrrolidin-1-yl)propylamino]phenyl]-2-phenylacetamide

C21H25N3O3 — CID 135320225

IUPACN-hydroxy-2-[3-[3-(2-oxopyrrolidin-1-yl)propylamino]phenyl]-2-phenylacetamide
SMILESO=C(NO)C(c1ccccc1)c1cccc(NCCCN2CCCC2=O)c1
InChIInChI=1S/C21H25N3O3/c25-19-11-5-13-24(19)14-6-12-22-18-10-4-9-17(15-18)20(21(26)23-27)16-7-2-1-3-8-16/h1-4,7-10,15,20,22,27H,5-6,11-14H2,(H,23,26)
InChIKeyMHAWSYYJOGFWAJ-UHFFFAOYSA-N
MW367.45 g/mol
LogP2.75
Rot. Bonds8

About N-hydroxy-2-[3-[3-(2-oxopyrrolidin-1-yl)propylamino]phenyl]-2-phenylacetamide

N-hydroxy-2-[3-[3-(2-oxopyrrolidin-1-yl)propylamino]phenyl]-2-phenylacetamide (PubChem CID 135320225) has the molecular formula C21H25N3O3 and a molecular weight of 367.45 g/mol. Its IUPAC name is N-hydroxy-2-[3-[3-(2-oxopyrrolidin-1-yl)propylamino]phenyl]-2-phenylacetamide.

Molecular Properties

Compound NameN-hydroxy-2-[3-[3-(2-oxopyrrolidin-1-yl)propylamino]phenyl]-2-phenylacetamide
PubChem CID135320225
Molecular FormulaC21H25N3O3
Molecular Weight367.45 g/mol
Exact Mass367.19
IUPAC NameN-hydroxy-2-[3-[3-(2-oxopyrrolidin-1-yl)propylamino]phenyl]-2-phenylacetamide
SMILESO=C(NO)C(c1ccccc1)c1cccc(NCCCN2CCCC2=O)c1
InChIInChI=1S/C21H25N3O3/c25-19-11-5-13-24(19)14-6-12-22-18-10-4-9-17(15-18)20(21(26)23-27)16-7-2-1-3-8-16/h1-4,7-10,15,20,22,27H,5-6,11-14H2,(H,23,26)
InChIKeyMHAWSYYJOGFWAJ-UHFFFAOYSA-N
XLogP2.75
TPSA81.67 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.45
LogP ≤ 52.75
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', '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-2-[3-[3-(2-oxopyrrolidin-1-yl)propylamino]phenyl]-2-phenylacetamide?
The IUPAC name of N-hydroxy-2-[3-[3-(2-oxopyrrolidin-1-yl)propylamino]phenyl]-2-phenylacetamide (CID 135320225) is N-hydroxy-2-[3-[3-(2-oxopyrrolidin-1-yl)propylamino]phenyl]-2-phenylacetamide.
What is the SMILES notation for N-hydroxy-2-[3-[3-(2-oxopyrrolidin-1-yl)propylamino]phenyl]-2-phenylacetamide?
The canonical SMILES for N-hydroxy-2-[3-[3-(2-oxopyrrolidin-1-yl)propylamino]phenyl]-2-phenylacetamide is O=C(NO)C(c1ccccc1)c1cccc(NCCCN2CCCC2=O)c1.
What is the InChIKey of N-hydroxy-2-[3-[3-(2-oxopyrrolidin-1-yl)propylamino]phenyl]-2-phenylacetamide?
The InChIKey is MHAWSYYJOGFWAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N3O3/c25-19-11-5-13-24(19)14-6-12-22-18-10-4-9-17(15-18)20(21(26)23-27)16-7-2-1-3-8-16/h1-4,7-10,15,20,22,27H,5-6,11-14H2,(H,23,26).
What are the key properties of N-hydroxy-2-[3-[3-(2-oxopyrrolidin-1-yl)propylamino]phenyl]-2-phenylacetamide?
N-hydroxy-2-[3-[3-(2-oxopyrrolidin-1-yl)propylamino]phenyl]-2-phenylacetamide has a molecular weight of 367.45 g/mol, XLogP of 2.75, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-2-[3-[3-(2-oxopyrrolidin-1-yl)propylamino]phenyl]-2-phenylacetamide is sourced from PubChem (CID 135320225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).