N-[6-(benzimidazol-1-yl)-3-pyridinyl]-4-(2-oxoimidazolidin-1-yl)benzamide

C22H18N6O2 — CID 134004831

IUPACN-[6-(benzimidazol-1-yl)-3-pyridinyl]-4-(2-oxoimidazolidin-1-yl)benzamide
SMILESO=C(Nc1ccc(-n2cnc3ccccc32)nc1)c1ccc(N2CCNC2=O)cc1
InChIInChI=1S/C22H18N6O2/c29-21(15-5-8-17(9-6-15)27-12-11-23-22(27)30)26-16-7-10-20(24-13-16)28-14-25-18-3-1-2-4-19(18)28/h1-10,13-14H,11-12H2,(H,23,30)(H,26,29)
InChIKeyLHYJKCRXSDUZFC-UHFFFAOYSA-N
MW398.43 g/mol
LogP3.20
Rot. Bonds4

About N-[6-(benzimidazol-1-yl)-3-pyridinyl]-4-(2-oxoimidazolidin-1-yl)benzamide

N-[6-(benzimidazol-1-yl)-3-pyridinyl]-4-(2-oxoimidazolidin-1-yl)benzamide (PubChem CID 134004831) has the molecular formula C22H18N6O2 and a molecular weight of 398.43 g/mol. Its IUPAC name is N-[6-(benzimidazol-1-yl)-3-pyridinyl]-4-(2-oxoimidazolidin-1-yl)benzamide.

Molecular Properties

Compound NameN-[6-(benzimidazol-1-yl)-3-pyridinyl]-4-(2-oxoimidazolidin-1-yl)benzamide
PubChem CID134004831
Molecular FormulaC22H18N6O2
Molecular Weight398.43 g/mol
Exact Mass398.15
IUPAC NameN-[6-(benzimidazol-1-yl)-3-pyridinyl]-4-(2-oxoimidazolidin-1-yl)benzamide
SMILESO=C(Nc1ccc(-n2cnc3ccccc32)nc1)c1ccc(N2CCNC2=O)cc1
InChIInChI=1S/C22H18N6O2/c29-21(15-5-8-17(9-6-15)27-12-11-23-22(27)30)26-16-7-10-20(24-13-16)28-14-25-18-3-1-2-4-19(18)28/h1-10,13-14H,11-12H2,(H,23,30)(H,26,29)
InChIKeyLHYJKCRXSDUZFC-UHFFFAOYSA-N
XLogP3.20
TPSA92.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.43
LogP ≤ 53.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-chloro-N-[4-(2-oxoimidazolidin-1-yl)phenyl]benzamide
CID 51299854
N-[6-(benzimidazol-1-yl)-3-pyridinyl]-2-fluorobenzamide
CID 134004736
N-[6-(2-oxo-3-phenylimidazolidin-1-yl)-3-pyridinyl]benzamide
CID 53187688
N-[6-(benzimidazol-1-yl)-3-pyridinyl]-4-imidazol-1-yl-3-nitrobenzamide
CID 55581027
4-(benzimidazol-1-yl)-N-[4-(4-methylpiperazin-1-yl)phenyl]benzamide
CID 78804591
N-(3,4-difluorophenyl)-4-(2-oxoimidazolidin-1-yl)benzamide
CID 51298991
4-methylsulfanyl-N-[4-(2-oxoimidazolidin-1-yl)phenyl]benzamide
CID 78831513
N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-4-(2-oxoimidazolidin-1-yl)benzamide
CID 51334693
N-[6-(benzimidazol-1-yl)-3-pyridinyl]-4-(4-bromophenyl)-4-oxobutanamide
CID 56532152
4-benzamido-N-[3-(2-oxoimidazolidin-1-yl)phenyl]benzamide
CID 55726264
5,6-dichloro-N-[4-(2-oxoimidazolidin-1-yl)phenyl]pyridine-3-carboxamide
CID 52545770
N-[6-(benzimidazol-1-yl)-3-pyridinyl]pentanamide
CID 134004728

Frequently Asked Questions

What is the IUPAC name of N-[6-(benzimidazol-1-yl)-3-pyridinyl]-4-(2-oxoimidazolidin-1-yl)benzamide?
The IUPAC name of N-[6-(benzimidazol-1-yl)-3-pyridinyl]-4-(2-oxoimidazolidin-1-yl)benzamide (CID 134004831) is N-[6-(benzimidazol-1-yl)-3-pyridinyl]-4-(2-oxoimidazolidin-1-yl)benzamide.
What is the SMILES notation for N-[6-(benzimidazol-1-yl)-3-pyridinyl]-4-(2-oxoimidazolidin-1-yl)benzamide?
The canonical SMILES for N-[6-(benzimidazol-1-yl)-3-pyridinyl]-4-(2-oxoimidazolidin-1-yl)benzamide is O=C(Nc1ccc(-n2cnc3ccccc32)nc1)c1ccc(N2CCNC2=O)cc1.
What is the InChIKey of N-[6-(benzimidazol-1-yl)-3-pyridinyl]-4-(2-oxoimidazolidin-1-yl)benzamide?
The InChIKey is LHYJKCRXSDUZFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N6O2/c29-21(15-5-8-17(9-6-15)27-12-11-23-22(27)30)26-16-7-10-20(24-13-16)28-14-25-18-3-1-2-4-19(18)28/h1-10,13-14H,11-12H2,(H,23,30)(H,26,29).
What are the key properties of N-[6-(benzimidazol-1-yl)-3-pyridinyl]-4-(2-oxoimidazolidin-1-yl)benzamide?
N-[6-(benzimidazol-1-yl)-3-pyridinyl]-4-(2-oxoimidazolidin-1-yl)benzamide has a molecular weight of 398.43 g/mol, XLogP of 3.20, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(benzimidazol-1-yl)-3-pyridinyl]-4-(2-oxoimidazolidin-1-yl)benzamide is sourced from PubChem (CID 134004831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).