1-[1-[[5-(1-methylbenzimidazol-2-yl)furan-2-yl]methyl]piperidin-4-yl]pyrrolidin-2-one

C22H26N4O2 — CID 56868374

IUPAC1-[1-[[5-(1-methylbenzimidazol-2-yl)furan-2-yl]methyl]piperidin-4-yl]pyrrolidin-2-one
SMILESCn1c(-c2ccc(CN3CCC(N4CCCC4=O)CC3)o2)nc2ccccc21
InChIInChI=1S/C22H26N4O2/c1-24-19-6-3-2-5-18(19)23-22(24)20-9-8-17(28-20)15-25-13-10-16(11-14-25)26-12-4-7-21(26)27/h2-3,5-6,8-9,16H,4,7,10-15H2,1H3
InChIKeyXDUZKSSWLSUOKG-UHFFFAOYSA-N
MW378.48 g/mol
LogP3.42
Rot. Bonds4

About 1-[1-[[5-(1-methylbenzimidazol-2-yl)furan-2-yl]methyl]piperidin-4-yl]pyrrolidin-2-one

1-[1-[[5-(1-methylbenzimidazol-2-yl)furan-2-yl]methyl]piperidin-4-yl]pyrrolidin-2-one (PubChem CID 56868374) has the molecular formula C22H26N4O2 and a molecular weight of 378.48 g/mol. Its IUPAC name is 1-[1-[[5-(1-methylbenzimidazol-2-yl)furan-2-yl]methyl]piperidin-4-yl]pyrrolidin-2-one.

Molecular Properties

Compound Name1-[1-[[5-(1-methylbenzimidazol-2-yl)furan-2-yl]methyl]piperidin-4-yl]pyrrolidin-2-one
PubChem CID56868374
Molecular FormulaC22H26N4O2
Molecular Weight378.48 g/mol
Exact Mass378.21
IUPAC Name1-[1-[[5-(1-methylbenzimidazol-2-yl)furan-2-yl]methyl]piperidin-4-yl]pyrrolidin-2-one
SMILESCn1c(-c2ccc(CN3CCC(N4CCCC4=O)CC3)o2)nc2ccccc21
InChIInChI=1S/C22H26N4O2/c1-24-19-6-3-2-5-18(19)23-22(24)20-9-8-17(28-20)15-25-13-10-16(11-14-25)26-12-4-7-21(26)27/h2-3,5-6,8-9,16H,4,7,10-15H2,1H3
InChIKeyXDUZKSSWLSUOKG-UHFFFAOYSA-N
XLogP3.42
TPSA54.51 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.48
LogP ≤ 53.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 1-[1-[[5-(1-methylbenzimidazol-2-yl)furan-2-yl]methyl]piperidin-4-yl]pyrrolidin-2-one with MolForge

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Related Compounds

1-methyl-2-[5-(piperidin-1-ylmethyl)furan-2-yl]benzimidazole
CID 665081
3-amino-1-[[5-(1-methylbenzimidazol-2-yl)furan-2-yl]methyl]pyrrolidine-3-carboxylic acid
CID 56719056
2-[[4-(2-oxopyrrolidin-1-yl)piperidin-1-yl]methyl]benzoic acid
CID 56876211
(2S,4R)-4-amino-N-methyl-1-[[5-(1-methylbenzimidazol-2-yl)furan-2-yl]methyl]pyrrolidine-2-carboxamide
CID 56710024
1-[1-(2-methyl-2-phenylpropyl)piperidin-4-yl]pyrrolidin-2-one
CID 86782293
1-[1-(3-ethyl-2-methylquinolin-4-yl)piperidin-4-yl]pyrrolidin-2-one
CID 138042688
1-[1-[(2,4-difluorophenyl)methyl]piperidin-4-yl]pyrrolidin-2-one
CID 74241962
1-[1-[(2-cyclopentyloxyphenyl)methyl]piperidin-4-yl]pyrrolidin-2-one
CID 126771040
1-[1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]azepan-2-one
CID 134792490
1-methyl-2-[(4-methylpiperidin-1-yl)methyl]benzimidazole
CID 6491167
4-ethyl-3-[1-[(1-methylbenzimidazol-2-yl)methyl]piperidin-4-yl]-1,3-oxazolidin-2-one
CID 3419556
1-[1-[2-(1H-indol-3-yl)ethyl]piperidin-4-yl]pyrrolidin-2-one
CID 56872329

Frequently Asked Questions

What is the IUPAC name of 1-[1-[[5-(1-methylbenzimidazol-2-yl)furan-2-yl]methyl]piperidin-4-yl]pyrrolidin-2-one?
The IUPAC name of 1-[1-[[5-(1-methylbenzimidazol-2-yl)furan-2-yl]methyl]piperidin-4-yl]pyrrolidin-2-one (CID 56868374) is 1-[1-[[5-(1-methylbenzimidazol-2-yl)furan-2-yl]methyl]piperidin-4-yl]pyrrolidin-2-one.
What is the SMILES notation for 1-[1-[[5-(1-methylbenzimidazol-2-yl)furan-2-yl]methyl]piperidin-4-yl]pyrrolidin-2-one?
The canonical SMILES for 1-[1-[[5-(1-methylbenzimidazol-2-yl)furan-2-yl]methyl]piperidin-4-yl]pyrrolidin-2-one is Cn1c(-c2ccc(CN3CCC(N4CCCC4=O)CC3)o2)nc2ccccc21.
What is the InChIKey of 1-[1-[[5-(1-methylbenzimidazol-2-yl)furan-2-yl]methyl]piperidin-4-yl]pyrrolidin-2-one?
The InChIKey is XDUZKSSWLSUOKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N4O2/c1-24-19-6-3-2-5-18(19)23-22(24)20-9-8-17(28-20)15-25-13-10-16(11-14-25)26-12-4-7-21(26)27/h2-3,5-6,8-9,16H,4,7,10-15H2,1H3.
What are the key properties of 1-[1-[[5-(1-methylbenzimidazol-2-yl)furan-2-yl]methyl]piperidin-4-yl]pyrrolidin-2-one?
1-[1-[[5-(1-methylbenzimidazol-2-yl)furan-2-yl]methyl]piperidin-4-yl]pyrrolidin-2-one has a molecular weight of 378.48 g/mol, XLogP of 3.42, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[[5-(1-methylbenzimidazol-2-yl)furan-2-yl]methyl]piperidin-4-yl]pyrrolidin-2-one is sourced from PubChem (CID 56868374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).