N-[[2-(hydroxymethyl)phenyl]methyl]-4-(2-oxoimidazolidin-1-yl)benzamide

C18H19N3O3 — CID 71883331

IUPACN-[[2-(hydroxymethyl)phenyl]methyl]-4-(2-oxoimidazolidin-1-yl)benzamide
SMILESO=C(NCc1ccccc1CO)c1ccc(N2CCNC2=O)cc1
InChIInChI=1S/C18H19N3O3/c22-12-15-4-2-1-3-14(15)11-20-17(23)13-5-7-16(8-6-13)21-10-9-19-18(21)24/h1-8,22H,9-12H2,(H,19,24)(H,20,23)
InChIKeyVWKLWCXRQMCVLS-UHFFFAOYSA-N
MW325.37 g/mol
LogP1.64
Rot. Bonds5

About N-[[2-(hydroxymethyl)phenyl]methyl]-4-(2-oxoimidazolidin-1-yl)benzamide

N-[[2-(hydroxymethyl)phenyl]methyl]-4-(2-oxoimidazolidin-1-yl)benzamide (PubChem CID 71883331) has the molecular formula C18H19N3O3 and a molecular weight of 325.37 g/mol. Its IUPAC name is N-[[2-(hydroxymethyl)phenyl]methyl]-4-(2-oxoimidazolidin-1-yl)benzamide.

Molecular Properties

Compound NameN-[[2-(hydroxymethyl)phenyl]methyl]-4-(2-oxoimidazolidin-1-yl)benzamide
PubChem CID71883331
Molecular FormulaC18H19N3O3
Molecular Weight325.37 g/mol
Exact Mass325.14
IUPAC NameN-[[2-(hydroxymethyl)phenyl]methyl]-4-(2-oxoimidazolidin-1-yl)benzamide
SMILESO=C(NCc1ccccc1CO)c1ccc(N2CCNC2=O)cc1
InChIInChI=1S/C18H19N3O3/c22-12-15-4-2-1-3-14(15)11-20-17(23)13-5-7-16(8-6-13)21-10-9-19-18(21)24/h1-8,22H,9-12H2,(H,19,24)(H,20,23)
InChIKeyVWKLWCXRQMCVLS-UHFFFAOYSA-N
XLogP1.64
TPSA81.67 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.37
LogP ≤ 51.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-(2-oxoimidazolidin-1-yl)-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]benzamide
CID 46524589
N-[(2-methoxyphenyl)methyl]-4-(2-oxoimidazolidin-1-yl)benzamide
CID 51299036
N-[2-(2-fluorophenyl)ethyl]-4-(2-oxoimidazolidin-1-yl)benzamide
CID 51299311
N-(3-aminobutyl)-4-(2-oxoimidazolidin-1-yl)benzamide
CID 119497450
4-acetyl-N-[[2-(hydroxymethyl)phenyl]methyl]benzamide
CID 111115313
7-[[4-(2-oxoimidazolidin-1-yl)benzoyl]amino]heptanoic acid
CID 119227169
4-(2-oxoimidazolidin-1-yl)-N-(2-thiophen-2-ylethyl)benzamide
CID 51074825
N-(2-methylphenyl)-4-(2-oxoimidazolidin-1-yl)benzamide
CID 46687823
4-ethyl-N-[[2-(hydroxymethyl)phenyl]methyl]benzamide
CID 110902443
N-(2,6-dimethylphenyl)-4-(2-oxoimidazolidin-1-yl)benzamide
CID 110857589
N-[3-[4-(2-oxoimidazolidin-1-yl)phenyl]prop-2-ynyl]-4-phenoxybenzamide
CID 90552526
4-(2-oxopiperidin-1-yl)-N-[[2-(piperidin-1-ylmethyl)phenyl]methyl]benzamide
CID 24516619

Frequently Asked Questions

What is the IUPAC name of N-[[2-(hydroxymethyl)phenyl]methyl]-4-(2-oxoimidazolidin-1-yl)benzamide?
The IUPAC name of N-[[2-(hydroxymethyl)phenyl]methyl]-4-(2-oxoimidazolidin-1-yl)benzamide (CID 71883331) is N-[[2-(hydroxymethyl)phenyl]methyl]-4-(2-oxoimidazolidin-1-yl)benzamide.
What is the SMILES notation for N-[[2-(hydroxymethyl)phenyl]methyl]-4-(2-oxoimidazolidin-1-yl)benzamide?
The canonical SMILES for N-[[2-(hydroxymethyl)phenyl]methyl]-4-(2-oxoimidazolidin-1-yl)benzamide is O=C(NCc1ccccc1CO)c1ccc(N2CCNC2=O)cc1.
What is the InChIKey of N-[[2-(hydroxymethyl)phenyl]methyl]-4-(2-oxoimidazolidin-1-yl)benzamide?
The InChIKey is VWKLWCXRQMCVLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O3/c22-12-15-4-2-1-3-14(15)11-20-17(23)13-5-7-16(8-6-13)21-10-9-19-18(21)24/h1-8,22H,9-12H2,(H,19,24)(H,20,23).
What are the key properties of N-[[2-(hydroxymethyl)phenyl]methyl]-4-(2-oxoimidazolidin-1-yl)benzamide?
N-[[2-(hydroxymethyl)phenyl]methyl]-4-(2-oxoimidazolidin-1-yl)benzamide has a molecular weight of 325.37 g/mol, XLogP of 1.64, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(hydroxymethyl)phenyl]methyl]-4-(2-oxoimidazolidin-1-yl)benzamide is sourced from PubChem (CID 71883331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).