2-methyl-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one;dihydrochloride

C11H20Cl2N4O — CID 66852833

IUPAC2-methyl-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one;dihydrochloride
SMILESCN1C=C2C(=O)N(C3CCNCC3)CN2C1.Cl.Cl
InChIInChI=1S/C11H18N4O.2ClH/c1-13-6-10-11(16)15(8-14(10)7-13)9-2-4-12-5-3-9;;/h6,9,12H,2-5,7-8H2,1H3;2*1H
InChIKeyWANVJFBCXYMWLP-UHFFFAOYSA-N
MW295.21 g/mol
LogP0.43
Rot. Bonds1

About 2-methyl-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one;dihydrochloride

2-methyl-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one;dihydrochloride (PubChem CID 66852833) has the molecular formula C11H20Cl2N4O and a molecular weight of 295.21 g/mol. Its IUPAC name is 2-methyl-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one;dihydrochloride.

Molecular Properties

Compound Name2-methyl-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one;dihydrochloride
PubChem CID66852833
Molecular FormulaC11H20Cl2N4O
Molecular Weight295.21 g/mol
Exact Mass294.10
IUPAC Name2-methyl-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one;dihydrochloride
SMILESCN1C=C2C(=O)N(C3CCNCC3)CN2C1.Cl.Cl
InChIInChI=1S/C11H18N4O.2ClH/c1-13-6-10-11(16)15(8-14(10)7-13)9-2-4-12-5-3-9;;/h6,9,12H,2-5,7-8H2,1H3;2*1H
InChIKeyWANVJFBCXYMWLP-UHFFFAOYSA-N
XLogP0.43
TPSA38.82 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.21
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one;dihydrochloride?
The IUPAC name of 2-methyl-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one;dihydrochloride (CID 66852833) is 2-methyl-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one;dihydrochloride.
What is the SMILES notation for 2-methyl-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one;dihydrochloride?
The canonical SMILES for 2-methyl-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one;dihydrochloride is CN1C=C2C(=O)N(C3CCNCC3)CN2C1.Cl.Cl.
What is the InChIKey of 2-methyl-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one;dihydrochloride?
The InChIKey is WANVJFBCXYMWLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O.2ClH/c1-13-6-10-11(16)15(8-14(10)7-13)9-2-4-12-5-3-9;;/h6,9,12H,2-5,7-8H2,1H3;2*1H.
What are the key properties of 2-methyl-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one;dihydrochloride?
2-methyl-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one;dihydrochloride has a molecular weight of 295.21 g/mol, XLogP of 0.43, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one;dihydrochloride is sourced from PubChem (CID 66852833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).