N-[1-[(3-methoxyphenyl)methyl]piperidin-3-yl]-3-(2-oxoimidazolidin-1-yl)benzamide

C23H28N4O3 — CID 45210664

IUPACN-[1-[(3-methoxyphenyl)methyl]piperidin-3-yl]-3-(2-oxoimidazolidin-1-yl)benzamide
SMILESCOc1cccc(CN2CCCC(NC(=O)c3cccc(N4CCNC4=O)c3)C2)c1
InChIInChI=1S/C23H28N4O3/c1-30-21-9-2-5-17(13-21)15-26-11-4-7-19(16-26)25-22(28)18-6-3-8-20(14-18)27-12-10-24-23(27)29/h2-3,5-6,8-9,13-14,19H,4,7,10-12,15-16H2,1H3,(H,24,29)(H,25,28)
InChIKeyDUSRKZYOEWUNBM-UHFFFAOYSA-N
MW408.50 g/mol
LogP2.62
Rot. Bonds6

About N-[1-[(3-methoxyphenyl)methyl]piperidin-3-yl]-3-(2-oxoimidazolidin-1-yl)benzamide

N-[1-[(3-methoxyphenyl)methyl]piperidin-3-yl]-3-(2-oxoimidazolidin-1-yl)benzamide (PubChem CID 45210664) has the molecular formula C23H28N4O3 and a molecular weight of 408.50 g/mol. Its IUPAC name is N-[1-[(3-methoxyphenyl)methyl]piperidin-3-yl]-3-(2-oxoimidazolidin-1-yl)benzamide.

Molecular Properties

Compound NameN-[1-[(3-methoxyphenyl)methyl]piperidin-3-yl]-3-(2-oxoimidazolidin-1-yl)benzamide
PubChem CID45210664
Molecular FormulaC23H28N4O3
Molecular Weight408.50 g/mol
Exact Mass408.22
IUPAC NameN-[1-[(3-methoxyphenyl)methyl]piperidin-3-yl]-3-(2-oxoimidazolidin-1-yl)benzamide
SMILESCOc1cccc(CN2CCCC(NC(=O)c3cccc(N4CCNC4=O)c3)C2)c1
InChIInChI=1S/C23H28N4O3/c1-30-21-9-2-5-17(13-21)15-26-11-4-7-19(16-26)25-22(28)18-6-3-8-20(14-18)27-12-10-24-23(27)29/h2-3,5-6,8-9,13-14,19H,4,7,10-12,15-16H2,1H3,(H,24,29)(H,25,28)
InChIKeyDUSRKZYOEWUNBM-UHFFFAOYSA-N
XLogP2.62
TPSA73.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.50
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-chloro-N-[(3S)-1-[(3-methoxyphenyl)methyl]piperidin-3-yl]benzamide
CID 25449017
N-[(3S)-1-[(3-methoxyphenyl)methyl]piperidin-3-yl]-4,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide
CID 25374475
N-(1-cyclopropylpyrrolidin-3-yl)-3-(2-oxoimidazolidin-1-yl)benzamide
CID 51100170
3-iodo-N-[1-[(3-methoxyphenyl)methyl]piperidin-4-yl]benzamide
CID 55945445
N-[1-[(3-methoxyphenyl)methyl]piperidin-3-yl]-5-methyl-1-propylpyrazole-4-carboxamide
CID 45187769
N-[1-[(3-methoxyphenyl)methyl]piperidin-3-yl]imidazo[2,1-b][1,3]thiazole-6-carboxamide
CID 56902955
N-[(3S)-1-[(4-fluorophenyl)methyl]piperidin-3-yl]-4-methoxypyridine-2-carboxamide
CID 126448618
N-[(3S)-1-benzylpyrrolidin-3-yl]-3-(2-oxopyrrolidin-1-yl)benzamide
CID 40952996
1-cyclopentyl-3-[1-[[4-(3-methoxyphenyl)phenyl]methyl]piperidin-3-yl]urea
CID 134802563
N-[2-(2,4-dimethoxyphenyl)ethyl]-3-(2-oxoimidazolidin-1-yl)benzamide
CID 72940866
N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-3-(2-oxoimidazolidin-1-yl)benzamide
CID 55851280
N-[(3R,4R)-4-hydroxy-1-[(3-methoxyphenyl)methyl]azepan-3-yl]-4-phenylmethoxybenzamide
CID 26741961

Frequently Asked Questions

What is the IUPAC name of N-[1-[(3-methoxyphenyl)methyl]piperidin-3-yl]-3-(2-oxoimidazolidin-1-yl)benzamide?
The IUPAC name of N-[1-[(3-methoxyphenyl)methyl]piperidin-3-yl]-3-(2-oxoimidazolidin-1-yl)benzamide (CID 45210664) is N-[1-[(3-methoxyphenyl)methyl]piperidin-3-yl]-3-(2-oxoimidazolidin-1-yl)benzamide.
What is the SMILES notation for N-[1-[(3-methoxyphenyl)methyl]piperidin-3-yl]-3-(2-oxoimidazolidin-1-yl)benzamide?
The canonical SMILES for N-[1-[(3-methoxyphenyl)methyl]piperidin-3-yl]-3-(2-oxoimidazolidin-1-yl)benzamide is COc1cccc(CN2CCCC(NC(=O)c3cccc(N4CCNC4=O)c3)C2)c1.
What is the InChIKey of N-[1-[(3-methoxyphenyl)methyl]piperidin-3-yl]-3-(2-oxoimidazolidin-1-yl)benzamide?
The InChIKey is DUSRKZYOEWUNBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N4O3/c1-30-21-9-2-5-17(13-21)15-26-11-4-7-19(16-26)25-22(28)18-6-3-8-20(14-18)27-12-10-24-23(27)29/h2-3,5-6,8-9,13-14,19H,4,7,10-12,15-16H2,1H3,(H,24,29)(H,25,28).
What are the key properties of N-[1-[(3-methoxyphenyl)methyl]piperidin-3-yl]-3-(2-oxoimidazolidin-1-yl)benzamide?
N-[1-[(3-methoxyphenyl)methyl]piperidin-3-yl]-3-(2-oxoimidazolidin-1-yl)benzamide has a molecular weight of 408.50 g/mol, XLogP of 2.62, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[(3-methoxyphenyl)methyl]piperidin-3-yl]-3-(2-oxoimidazolidin-1-yl)benzamide is sourced from PubChem (CID 45210664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).