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

C10H18Cl2N4O — CID 68646769

IUPAC2-methyl-6-pyrrolidin-3-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one;dihydrochloride
SMILESCN1C=C2C(=O)N(C3CCNC3)CN2C1.Cl.Cl
InChIInChI=1S/C10H16N4O.2ClH/c1-12-5-9-10(15)14(7-13(9)6-12)8-2-3-11-4-8;;/h5,8,11H,2-4,6-7H2,1H3;2*1H
InChIKeyAMEWXILEAXVOMO-UHFFFAOYSA-N
MW281.19 g/mol
LogP0.04
Rot. Bonds1

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

2-methyl-6-pyrrolidin-3-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one;dihydrochloride (PubChem CID 68646769) has the molecular formula C10H18Cl2N4O and a molecular weight of 281.19 g/mol. Its IUPAC name is 2-methyl-6-pyrrolidin-3-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one;dihydrochloride.

Molecular Properties

Compound Name2-methyl-6-pyrrolidin-3-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one;dihydrochloride
PubChem CID68646769
Molecular FormulaC10H18Cl2N4O
Molecular Weight281.19 g/mol
Exact Mass280.09
IUPAC Name2-methyl-6-pyrrolidin-3-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one;dihydrochloride
SMILESCN1C=C2C(=O)N(C3CCNC3)CN2C1.Cl.Cl
InChIInChI=1S/C10H16N4O.2ClH/c1-12-5-9-10(15)14(7-13(9)6-12)8-2-3-11-4-8;;/h5,8,11H,2-4,6-7H2,1H3;2*1H
InChIKeyAMEWXILEAXVOMO-UHFFFAOYSA-N
XLogP0.04
TPSA38.82 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.19
LogP ≤ 50.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-pyrrolidin-3-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one;dihydrochloride?
The IUPAC name of 2-methyl-6-pyrrolidin-3-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one;dihydrochloride (CID 68646769) is 2-methyl-6-pyrrolidin-3-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one;dihydrochloride.
What is the SMILES notation for 2-methyl-6-pyrrolidin-3-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one;dihydrochloride?
The canonical SMILES for 2-methyl-6-pyrrolidin-3-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one;dihydrochloride is CN1C=C2C(=O)N(C3CCNC3)CN2C1.Cl.Cl.
What is the InChIKey of 2-methyl-6-pyrrolidin-3-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one;dihydrochloride?
The InChIKey is AMEWXILEAXVOMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O.2ClH/c1-12-5-9-10(15)14(7-13(9)6-12)8-2-3-11-4-8;;/h5,8,11H,2-4,6-7H2,1H3;2*1H.
What are the key properties of 2-methyl-6-pyrrolidin-3-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one;dihydrochloride?
2-methyl-6-pyrrolidin-3-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one;dihydrochloride has a molecular weight of 281.19 g/mol, XLogP of 0.04, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-pyrrolidin-3-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one;dihydrochloride is sourced from PubChem (CID 68646769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).