1,3-dimethyl-6-(2-piperidin-4-ylethyl)-7H-imidazo[1,5-c]imidazol-5-one

C14H22N4O — CID 23138196

IUPAC1,3-dimethyl-6-(2-piperidin-4-ylethyl)-7H-imidazo[1,5-c]imidazol-5-one
SMILESCc1nc(C)n2c1CN(CCC1CCNCC1)C2=O
InChIInChI=1S/C14H22N4O/c1-10-13-9-17(14(19)18(13)11(2)16-10)8-5-12-3-6-15-7-4-12/h12,15H,3-9H2,1-2H3
InChIKeyLGHXUBRWQJUGDY-UHFFFAOYSA-N
MW262.36 g/mol
LogP1.67
Rot. Bonds3

About 1,3-dimethyl-6-(2-piperidin-4-ylethyl)-7H-imidazo[1,5-c]imidazol-5-one

1,3-dimethyl-6-(2-piperidin-4-ylethyl)-7H-imidazo[1,5-c]imidazol-5-one (PubChem CID 23138196) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is 1,3-dimethyl-6-(2-piperidin-4-ylethyl)-7H-imidazo[1,5-c]imidazol-5-one.

Molecular Properties

Compound Name1,3-dimethyl-6-(2-piperidin-4-ylethyl)-7H-imidazo[1,5-c]imidazol-5-one
PubChem CID23138196
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC Name1,3-dimethyl-6-(2-piperidin-4-ylethyl)-7H-imidazo[1,5-c]imidazol-5-one
SMILESCc1nc(C)n2c1CN(CCC1CCNCC1)C2=O
InChIInChI=1S/C14H22N4O/c1-10-13-9-17(14(19)18(13)11(2)16-10)8-5-12-3-6-15-7-4-12/h12,15H,3-9H2,1-2H3
InChIKeyLGHXUBRWQJUGDY-UHFFFAOYSA-N
XLogP1.67
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1,3-dimethyl-6-(2-piperidin-4-ylethyl)-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

1-tert-butyl-3-[[1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]piperidin-3-yl]methyl]urea
CID 56749862
tert-butyl 4-(5,7-dimethyl-3-oxo-1H-imidazo[1,5-c]imidazol-2(3H)-yl)-1-piperidinecarboxylate
CID 23084249
1,3-dimethyl-6-piperidin-4-yl-7H-imidazo[1,5-c]imidazol-5-one
CID 23084270
5-methyl-2-(4-piperidinyl)methyl-1,2-dihydro-3H-imidazo[1,5-c]imidazol-3-one dihydrochloride
CID 23138137
3-methyl-6-(piperidin-4-ylmethyl)-7H-imidazo[1,5-c]imidazol-5-one
CID 23138138
1,3-dimethyl-6-piperazin-1-yl-7H-imidazo[1,5-c]imidazol-5-one
CID 23138151
1,3-dimethyl-6-(2-piperazin-1-ylethyl)-7H-imidazo[1,5-c]imidazol-5-one
CID 23138284
5-Methyl-2-(2-(4-piperidinyl)ethyl)-1,2-dihydroimidazo[1,5-c]imidazol-3-one
CID 23138322
N-[2-(4,5-dimethyl-2-piperidin-3-ylimidazol-1-yl)ethyl]acetamide
CID 66791491
1-methyl-6-piperazin-1-yl-7H-imidazo[1,5-c]imidazol-5-one
CID 140044891
7,8-dimethyl-6-(4-methylpentylamino)-3H-purin-2-one
CID 163570807
N-ethyl-N'-({1-[(2-ethyl-4-methyl-1H-imidazol-5-yl)methyl]piperidin-4-yl}methyl)urea
CID 56742859

Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-6-(2-piperidin-4-ylethyl)-7H-imidazo[1,5-c]imidazol-5-one?
The IUPAC name of 1,3-dimethyl-6-(2-piperidin-4-ylethyl)-7H-imidazo[1,5-c]imidazol-5-one (CID 23138196) is 1,3-dimethyl-6-(2-piperidin-4-ylethyl)-7H-imidazo[1,5-c]imidazol-5-one.
What is the SMILES notation for 1,3-dimethyl-6-(2-piperidin-4-ylethyl)-7H-imidazo[1,5-c]imidazol-5-one?
The canonical SMILES for 1,3-dimethyl-6-(2-piperidin-4-ylethyl)-7H-imidazo[1,5-c]imidazol-5-one is Cc1nc(C)n2c1CN(CCC1CCNCC1)C2=O.
What is the InChIKey of 1,3-dimethyl-6-(2-piperidin-4-ylethyl)-7H-imidazo[1,5-c]imidazol-5-one?
The InChIKey is LGHXUBRWQJUGDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-10-13-9-17(14(19)18(13)11(2)16-10)8-5-12-3-6-15-7-4-12/h12,15H,3-9H2,1-2H3.
What are the key properties of 1,3-dimethyl-6-(2-piperidin-4-ylethyl)-7H-imidazo[1,5-c]imidazol-5-one?
1,3-dimethyl-6-(2-piperidin-4-ylethyl)-7H-imidazo[1,5-c]imidazol-5-one has a molecular weight of 262.36 g/mol, XLogP of 1.67, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-6-(2-piperidin-4-ylethyl)-7H-imidazo[1,5-c]imidazol-5-one is sourced from PubChem (CID 23138196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).