4-ethyl-3-[1-[(1-methylbenzimidazol-2-yl)methyl]piperidin-4-yl]-1,3-oxazolidin-2-one

C19H26N4O2 — CID 3419556

IUPAC4-ethyl-3-[1-[(1-methylbenzimidazol-2-yl)methyl]piperidin-4-yl]-1,3-oxazolidin-2-one
SMILESCCC1COC(=O)N1C1CCN(Cc2nc3ccccc3n2C)CC1
InChIInChI=1S/C19H26N4O2/c1-3-14-13-25-19(24)23(14)15-8-10-22(11-9-15)12-18-20-16-6-4-5-7-17(16)21(18)2/h4-7,14-15H,3,8-13H2,1-2H3
InChIKeyQJCVHJBVBRMMFK-UHFFFAOYSA-N
MW342.44 g/mol
LogP2.77
Rot. Bonds4

About 4-ethyl-3-[1-[(1-methylbenzimidazol-2-yl)methyl]piperidin-4-yl]-1,3-oxazolidin-2-one

4-ethyl-3-[1-[(1-methylbenzimidazol-2-yl)methyl]piperidin-4-yl]-1,3-oxazolidin-2-one (PubChem CID 3419556) has the molecular formula C19H26N4O2 and a molecular weight of 342.44 g/mol. Its IUPAC name is 4-ethyl-3-[1-[(1-methylbenzimidazol-2-yl)methyl]piperidin-4-yl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name4-ethyl-3-[1-[(1-methylbenzimidazol-2-yl)methyl]piperidin-4-yl]-1,3-oxazolidin-2-one
PubChem CID3419556
Molecular FormulaC19H26N4O2
Molecular Weight342.44 g/mol
Exact Mass342.21
IUPAC Name4-ethyl-3-[1-[(1-methylbenzimidazol-2-yl)methyl]piperidin-4-yl]-1,3-oxazolidin-2-one
SMILESCCC1COC(=O)N1C1CCN(Cc2nc3ccccc3n2C)CC1
InChIInChI=1S/C19H26N4O2/c1-3-14-13-25-19(24)23(14)15-8-10-22(11-9-15)12-18-20-16-6-4-5-7-17(16)21(18)2/h4-7,14-15H,3,8-13H2,1-2H3
InChIKeyQJCVHJBVBRMMFK-UHFFFAOYSA-N
XLogP2.77
TPSA50.60 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.44
LogP ≤ 52.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 4-ethyl-3-[1-[(1-methylbenzimidazol-2-yl)methyl]piperidin-4-yl]-1,3-oxazolidin-2-one with MolForge

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Related Compounds

1-methyl-2-[(4-methylpiperidin-1-yl)methyl]benzimidazole
CID 6491167
1-methyl-2-(1,4,7-triazonan-1-ylmethyl)benzimidazole
CID 70105474
4-[1-[(1-methylbenzimidazol-2-yl)methyl]piperidine-4-carbonyl]piperazine-1-carbaldehyde
CID 125113468
2-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]-1-methylbenzimidazole
CID 24849789
1-[(1-methylbenzimidazol-2-yl)methyl]-N-pyridin-4-ylpiperidine-4-carboxamide
CID 124814493
[1-[(1-methylbenzimidazol-2-yl)methyl]piperidin-4-yl]-(4-phenylpiperazin-1-yl)methanone
CID 124814185
1-methyl-2-[[4-(2-propan-2-yloxyphenyl)piperidin-1-yl]methyl]benzimidazole
CID 24815438
3-[1-[(1-methylbenzimidazol-2-yl)methyl]piperidin-4-yl]-1,2-benzothiazole
CID 46225583
[(3R)-1-[(1-methylbenzimidazol-2-yl)methyl]piperidin-3-yl]-piperidin-1-ylmethanone
CID 124813623
3-(2,3-dihydro-1H-inden-2-yl)-1-ethyl-8-[(1-methylbenzimidazol-2-yl)methyl]-1,3,8-triazaspiro[4.5]decane-2,4-dione
CID 26228809
2-[(4-methylpiperidin-1-yl)methyl]-1-propylbenzimidazole
CID 6491176
(3R)-1-[(1-methylbenzimidazol-2-yl)methyl]-N,N-dipropylpiperidine-3-carboxamide
CID 124814723

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-3-[1-[(1-methylbenzimidazol-2-yl)methyl]piperidin-4-yl]-1,3-oxazolidin-2-one?
The IUPAC name of 4-ethyl-3-[1-[(1-methylbenzimidazol-2-yl)methyl]piperidin-4-yl]-1,3-oxazolidin-2-one (CID 3419556) is 4-ethyl-3-[1-[(1-methylbenzimidazol-2-yl)methyl]piperidin-4-yl]-1,3-oxazolidin-2-one.
What is the SMILES notation for 4-ethyl-3-[1-[(1-methylbenzimidazol-2-yl)methyl]piperidin-4-yl]-1,3-oxazolidin-2-one?
The canonical SMILES for 4-ethyl-3-[1-[(1-methylbenzimidazol-2-yl)methyl]piperidin-4-yl]-1,3-oxazolidin-2-one is CCC1COC(=O)N1C1CCN(Cc2nc3ccccc3n2C)CC1.
What is the InChIKey of 4-ethyl-3-[1-[(1-methylbenzimidazol-2-yl)methyl]piperidin-4-yl]-1,3-oxazolidin-2-one?
The InChIKey is QJCVHJBVBRMMFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O2/c1-3-14-13-25-19(24)23(14)15-8-10-22(11-9-15)12-18-20-16-6-4-5-7-17(16)21(18)2/h4-7,14-15H,3,8-13H2,1-2H3.
What are the key properties of 4-ethyl-3-[1-[(1-methylbenzimidazol-2-yl)methyl]piperidin-4-yl]-1,3-oxazolidin-2-one?
4-ethyl-3-[1-[(1-methylbenzimidazol-2-yl)methyl]piperidin-4-yl]-1,3-oxazolidin-2-one has a molecular weight of 342.44 g/mol, XLogP of 2.77, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-3-[1-[(1-methylbenzimidazol-2-yl)methyl]piperidin-4-yl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 3419556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).