6-(1-benzylpiperidin-4-yl)-3-(hydroxymethyl)-7H-imidazo[1,5-c]imidazol-5-one

C18H22N4O2 — CID 23084041

IUPAC6-(1-benzylpiperidin-4-yl)-3-(hydroxymethyl)-7H-imidazo[1,5-c]imidazol-5-one
SMILESO=C1N(C2CCN(Cc3ccccc3)CC2)Cc2cnc(CO)n21
InChIInChI=1S/C18H22N4O2/c23-13-17-19-10-16-12-21(18(24)22(16)17)15-6-8-20(9-7-15)11-14-4-2-1-3-5-14/h1-5,10,15,23H,6-9,11-13H2
InChIKeyQPXWQOILJMZJCP-UHFFFAOYSA-N
MW326.40 g/mol
LogP1.82
Rot. Bonds4

About 6-(1-benzylpiperidin-4-yl)-3-(hydroxymethyl)-7H-imidazo[1,5-c]imidazol-5-one

6-(1-benzylpiperidin-4-yl)-3-(hydroxymethyl)-7H-imidazo[1,5-c]imidazol-5-one (PubChem CID 23084041) has the molecular formula C18H22N4O2 and a molecular weight of 326.40 g/mol. Its IUPAC name is 6-(1-benzylpiperidin-4-yl)-3-(hydroxymethyl)-7H-imidazo[1,5-c]imidazol-5-one.

Molecular Properties

Compound Name6-(1-benzylpiperidin-4-yl)-3-(hydroxymethyl)-7H-imidazo[1,5-c]imidazol-5-one
PubChem CID23084041
Molecular FormulaC18H22N4O2
Molecular Weight326.40 g/mol
Exact Mass326.17
IUPAC Name6-(1-benzylpiperidin-4-yl)-3-(hydroxymethyl)-7H-imidazo[1,5-c]imidazol-5-one
SMILESO=C1N(C2CCN(Cc3ccccc3)CC2)Cc2cnc(CO)n21
InChIInChI=1S/C18H22N4O2/c23-13-17-19-10-16-12-21(18(24)22(16)17)15-6-8-20(9-7-15)11-14-4-2-1-3-5-14/h1-5,10,15,23H,6-9,11-13H2
InChIKeyQPXWQOILJMZJCP-UHFFFAOYSA-N
XLogP1.82
TPSA61.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-(1-benzylpiperidin-4-yl)-3-(hydroxymethyl)-7H-imidazo[1,5-c]imidazol-5-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-[1-[[4-(dimethylamino)phenyl]methyl]piperidin-4-yl]-3-methyl-7H-imidazo[1,5-c]imidazol-5-one
CID 134792844
(7aS)-2-(1-benzylpiperidin-4-yl)-5,6,7,7a-tetrahydro-1H-pyrrolo[1,2-c]imidazol-3-one
CID 46222885
6-(1-benzylpiperidin-4-yl)-7H-pyrrolo[3,4-b]pyridin-5-one
CID 50952033
1-(1-benzylpyrrolidin-3-yl)-4-(hydroxymethyl)pyrrolidin-2-one
CID 168661797
2-[[4-(1-benzylpiperidin-4-yl)-5-(hydroxymethyl)-1,2,4-triazol-3-yl]sulfanyl]acetic acid
CID 113268400
1-(1-benzylpiperidin-4-yl)-5-oxopyrrolidine-3-sulfonyl chloride
CID 168712027
2-(1-benzylpiperidin-4-yl)-3,4-dihydroisoquinolin-1-one
CID 21430540
1-(1-benzylpyrrolidin-3-yl)-4-sulfanylpyrrolidin-2-one
CID 168707846
4-(1-benzylpiperidin-4-yl)morpholin-3-one;ethane
CID 145162351
1-(1-benzylpiperidin-4-yl)-4,4-diphenylimidazolidin-2-one
CID 11718536
3-benzyl-1-cyclopropylimidazolidine-2,4-dione
CID 87022344
1-benzyl-4-fluoropiperidin-3-one
CID 83670241

Frequently Asked Questions

What is the IUPAC name of 6-(1-benzylpiperidin-4-yl)-3-(hydroxymethyl)-7H-imidazo[1,5-c]imidazol-5-one?
The IUPAC name of 6-(1-benzylpiperidin-4-yl)-3-(hydroxymethyl)-7H-imidazo[1,5-c]imidazol-5-one (CID 23084041) is 6-(1-benzylpiperidin-4-yl)-3-(hydroxymethyl)-7H-imidazo[1,5-c]imidazol-5-one.
What is the SMILES notation for 6-(1-benzylpiperidin-4-yl)-3-(hydroxymethyl)-7H-imidazo[1,5-c]imidazol-5-one?
The canonical SMILES for 6-(1-benzylpiperidin-4-yl)-3-(hydroxymethyl)-7H-imidazo[1,5-c]imidazol-5-one is O=C1N(C2CCN(Cc3ccccc3)CC2)Cc2cnc(CO)n21.
What is the InChIKey of 6-(1-benzylpiperidin-4-yl)-3-(hydroxymethyl)-7H-imidazo[1,5-c]imidazol-5-one?
The InChIKey is QPXWQOILJMZJCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N4O2/c23-13-17-19-10-16-12-21(18(24)22(16)17)15-6-8-20(9-7-15)11-14-4-2-1-3-5-14/h1-5,10,15,23H,6-9,11-13H2.
What are the key properties of 6-(1-benzylpiperidin-4-yl)-3-(hydroxymethyl)-7H-imidazo[1,5-c]imidazol-5-one?
6-(1-benzylpiperidin-4-yl)-3-(hydroxymethyl)-7H-imidazo[1,5-c]imidazol-5-one has a molecular weight of 326.40 g/mol, XLogP of 1.82, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-benzylpiperidin-4-yl)-3-(hydroxymethyl)-7H-imidazo[1,5-c]imidazol-5-one is sourced from PubChem (CID 23084041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).