N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]-3-(2-oxoimidazolidin-1-yl)benzamide

C23H28N4O3 — CID 55843403

IUPACN-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]-3-(2-oxoimidazolidin-1-yl)benzamide
SMILESCc1cccc(C(CNC(=O)c2cccc(N3CCNC3=O)c2)N2CCOCC2)c1
InChIInChI=1S/C23H28N4O3/c1-17-4-2-5-18(14-17)21(26-10-12-30-13-11-26)16-25-22(28)19-6-3-7-20(15-19)27-9-8-24-23(27)29/h2-7,14-15,21H,8-13,16H2,1H3,(H,24,29)(H,25,28)
InChIKeyFJFUQXMWMNHMNF-UHFFFAOYSA-N
MW408.50 g/mol
LogP2.33
Rot. Bonds6

About N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]-3-(2-oxoimidazolidin-1-yl)benzamide

N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]-3-(2-oxoimidazolidin-1-yl)benzamide (PubChem CID 55843403) has the molecular formula C23H28N4O3 and a molecular weight of 408.50 g/mol. Its IUPAC name is N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]-3-(2-oxoimidazolidin-1-yl)benzamide.

Molecular Properties

Compound NameN-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]-3-(2-oxoimidazolidin-1-yl)benzamide
PubChem CID55843403
Molecular FormulaC23H28N4O3
Molecular Weight408.50 g/mol
Exact Mass408.22
IUPAC NameN-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]-3-(2-oxoimidazolidin-1-yl)benzamide
SMILESCc1cccc(C(CNC(=O)c2cccc(N3CCNC3=O)c2)N2CCOCC2)c1
InChIInChI=1S/C23H28N4O3/c1-17-4-2-5-18(14-17)21(26-10-12-30-13-11-26)16-25-22(28)19-6-3-7-20(15-19)27-9-8-24-23(27)29/h2-7,14-15,21H,8-13,16H2,1H3,(H,24,29)(H,25,28)
InChIKeyFJFUQXMWMNHMNF-UHFFFAOYSA-N
XLogP2.33
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 ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]-4-pyrrol-1-ylbenzamide
CID 110304128
N-[(2S)-2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-3-(2-oxopyrrolidin-1-yl)benzamide
CID 39969594
3-bromo-N-[2-[[2-(3-methylphenyl)-2-morpholin-4-ylethyl]amino]-2-oxoethyl]benzamide
CID 55659969
2-(4-fluorophenyl)-N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]acetamide
CID 112506492
2-chloro-N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]acetamide;hydrochloride
CID 154856473
3-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide
CID 18164168
(2R)-2-amino-N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]propanamide
CID 119849688
N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-3-methylbenzamide;hydrochloride
CID 52984760
2-chloro-6-fluoro-N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]benzamide
CID 112506509
4-hydroxy-N-[2-[[(2S)-2-(3-methylphenyl)-2-morpholin-4-ylethyl]amino]-2-oxoethyl]benzamide
CID 95143165
3-methyl-N-[(2S)-2-(3-methylphenyl)-2-morpholin-4-ylethyl]-1,2-oxazole-5-carboxamide
CID 39226854
N-[2,3-bis(4-chlorophenyl)butyl]-3-(2-oxoimidazolidin-1-yl)benzamide
CID 69375843

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]-3-(2-oxoimidazolidin-1-yl)benzamide?
The IUPAC name of N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]-3-(2-oxoimidazolidin-1-yl)benzamide (CID 55843403) is N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]-3-(2-oxoimidazolidin-1-yl)benzamide.
What is the SMILES notation for N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]-3-(2-oxoimidazolidin-1-yl)benzamide?
The canonical SMILES for N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]-3-(2-oxoimidazolidin-1-yl)benzamide is Cc1cccc(C(CNC(=O)c2cccc(N3CCNC3=O)c2)N2CCOCC2)c1.
What is the InChIKey of N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]-3-(2-oxoimidazolidin-1-yl)benzamide?
The InChIKey is FJFUQXMWMNHMNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N4O3/c1-17-4-2-5-18(14-17)21(26-10-12-30-13-11-26)16-25-22(28)19-6-3-7-20(15-19)27-9-8-24-23(27)29/h2-7,14-15,21H,8-13,16H2,1H3,(H,24,29)(H,25,28).
What are the key properties of N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]-3-(2-oxoimidazolidin-1-yl)benzamide?
N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]-3-(2-oxoimidazolidin-1-yl)benzamide has a molecular weight of 408.50 g/mol, XLogP of 2.33, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]-3-(2-oxoimidazolidin-1-yl)benzamide is sourced from PubChem (CID 55843403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).