N-hydroxy-2-[3-[4-[(4-methoxyphenyl)methoxy]phenyl]-2-oxoimidazolidin-1-yl]propanamide

C20H23N3O5 — CID 44574448

IUPACN-hydroxy-2-[3-[4-[(4-methoxyphenyl)methoxy]phenyl]-2-oxoimidazolidin-1-yl]propanamide
SMILESCOc1ccc(COc2ccc(N3CCN(C(C)C(=O)NO)C3=O)cc2)cc1
InChIInChI=1S/C20H23N3O5/c1-14(19(24)21-26)22-11-12-23(20(22)25)16-5-9-18(10-6-16)28-13-15-3-7-17(27-2)8-4-15/h3-10,14,26H,11-13H2,1-2H3,(H,21,24)
InChIKeyJKMTWKFOEOLQQX-UHFFFAOYSA-N
MW385.42 g/mol
LogP2.41
Rot. Bonds7

About N-hydroxy-2-[3-[4-[(4-methoxyphenyl)methoxy]phenyl]-2-oxoimidazolidin-1-yl]propanamide

N-hydroxy-2-[3-[4-[(4-methoxyphenyl)methoxy]phenyl]-2-oxoimidazolidin-1-yl]propanamide (PubChem CID 44574448) has the molecular formula C20H23N3O5 and a molecular weight of 385.42 g/mol. Its IUPAC name is N-hydroxy-2-[3-[4-[(4-methoxyphenyl)methoxy]phenyl]-2-oxoimidazolidin-1-yl]propanamide.

Molecular Properties

Compound NameN-hydroxy-2-[3-[4-[(4-methoxyphenyl)methoxy]phenyl]-2-oxoimidazolidin-1-yl]propanamide
PubChem CID44574448
Molecular FormulaC20H23N3O5
Molecular Weight385.42 g/mol
Exact Mass385.16
IUPAC NameN-hydroxy-2-[3-[4-[(4-methoxyphenyl)methoxy]phenyl]-2-oxoimidazolidin-1-yl]propanamide
SMILESCOc1ccc(COc2ccc(N3CCN(C(C)C(=O)NO)C3=O)cc2)cc1
InChIInChI=1S/C20H23N3O5/c1-14(19(24)21-26)22-11-12-23(20(22)25)16-5-9-18(10-6-16)28-13-15-3-7-17(27-2)8-4-15/h3-10,14,26H,11-13H2,1-2H3,(H,21,24)
InChIKeyJKMTWKFOEOLQQX-UHFFFAOYSA-N
XLogP2.41
TPSA91.34 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.42
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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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Frequently Asked Questions

What is the IUPAC name of N-hydroxy-2-[3-[4-[(4-methoxyphenyl)methoxy]phenyl]-2-oxoimidazolidin-1-yl]propanamide?
The IUPAC name of N-hydroxy-2-[3-[4-[(4-methoxyphenyl)methoxy]phenyl]-2-oxoimidazolidin-1-yl]propanamide (CID 44574448) is N-hydroxy-2-[3-[4-[(4-methoxyphenyl)methoxy]phenyl]-2-oxoimidazolidin-1-yl]propanamide.
What is the SMILES notation for N-hydroxy-2-[3-[4-[(4-methoxyphenyl)methoxy]phenyl]-2-oxoimidazolidin-1-yl]propanamide?
The canonical SMILES for N-hydroxy-2-[3-[4-[(4-methoxyphenyl)methoxy]phenyl]-2-oxoimidazolidin-1-yl]propanamide is COc1ccc(COc2ccc(N3CCN(C(C)C(=O)NO)C3=O)cc2)cc1.
What is the InChIKey of N-hydroxy-2-[3-[4-[(4-methoxyphenyl)methoxy]phenyl]-2-oxoimidazolidin-1-yl]propanamide?
The InChIKey is JKMTWKFOEOLQQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O5/c1-14(19(24)21-26)22-11-12-23(20(22)25)16-5-9-18(10-6-16)28-13-15-3-7-17(27-2)8-4-15/h3-10,14,26H,11-13H2,1-2H3,(H,21,24).
What are the key properties of N-hydroxy-2-[3-[4-[(4-methoxyphenyl)methoxy]phenyl]-2-oxoimidazolidin-1-yl]propanamide?
N-hydroxy-2-[3-[4-[(4-methoxyphenyl)methoxy]phenyl]-2-oxoimidazolidin-1-yl]propanamide has a molecular weight of 385.42 g/mol, XLogP of 2.41, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-2-[3-[4-[(4-methoxyphenyl)methoxy]phenyl]-2-oxoimidazolidin-1-yl]propanamide is sourced from PubChem (CID 44574448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).