2-(methoxymethyl)-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one

C12H20N4O2 — CID 66854055

IUPAC2-(methoxymethyl)-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one
SMILESCOCN1C=C2C(=O)N(C3CCNCC3)CN2C1
InChIInChI=1S/C12H20N4O2/c1-18-9-14-6-11-12(17)16(8-15(11)7-14)10-2-4-13-5-3-10/h6,10,13H,2-5,7-9H2,1H3
InChIKeyARXIJGVGQFOXPZ-UHFFFAOYSA-N
MW252.32 g/mol
LogP-0.44
Rot. Bonds3

About 2-(methoxymethyl)-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one

2-(methoxymethyl)-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one (PubChem CID 66854055) has the molecular formula C12H20N4O2 and a molecular weight of 252.32 g/mol. Its IUPAC name is 2-(methoxymethyl)-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one.

Molecular Properties

Compound Name2-(methoxymethyl)-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one
PubChem CID66854055
Molecular FormulaC12H20N4O2
Molecular Weight252.32 g/mol
Exact Mass252.16
IUPAC Name2-(methoxymethyl)-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one
SMILESCOCN1C=C2C(=O)N(C3CCNCC3)CN2C1
InChIInChI=1S/C12H20N4O2/c1-18-9-14-6-11-12(17)16(8-15(11)7-14)10-2-4-13-5-3-10/h6,10,13H,2-5,7-9H2,1H3
InChIKeyARXIJGVGQFOXPZ-UHFFFAOYSA-N
XLogP-0.44
TPSA48.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 5-0.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethyl)-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one?
The IUPAC name of 2-(methoxymethyl)-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one (CID 66854055) is 2-(methoxymethyl)-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one.
What is the SMILES notation for 2-(methoxymethyl)-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one?
The canonical SMILES for 2-(methoxymethyl)-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one is COCN1C=C2C(=O)N(C3CCNCC3)CN2C1.
What is the InChIKey of 2-(methoxymethyl)-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one?
The InChIKey is ARXIJGVGQFOXPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O2/c1-18-9-14-6-11-12(17)16(8-15(11)7-14)10-2-4-13-5-3-10/h6,10,13H,2-5,7-9H2,1H3.
What are the key properties of 2-(methoxymethyl)-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one?
2-(methoxymethyl)-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one has a molecular weight of 252.32 g/mol, XLogP of -0.44, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one is sourced from PubChem (CID 66854055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).