5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2,2-dimethylcyclopentan-1-ol

C13H21N3O — CID 79857504

IUPAC5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2,2-dimethylcyclopentan-1-ol
SMILESCC1(C)CCC(N2CCn3ccnc3C2)C1O
InChIInChI=1S/C13H21N3O/c1-13(2)4-3-10(12(13)17)16-8-7-15-6-5-14-11(15)9-16/h5-6,10,12,17H,3-4,7-9H2,1-2H3
InChIKeySMHWMNQUKXOVMP-UHFFFAOYSA-N
MW235.33 g/mol
LogP1.25
Rot. Bonds1

About 5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2,2-dimethylcyclopentan-1-ol

5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2,2-dimethylcyclopentan-1-ol (PubChem CID 79857504) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is 5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2,2-dimethylcyclopentan-1-ol.

Molecular Properties

Compound Name5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2,2-dimethylcyclopentan-1-ol
PubChem CID79857504
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC Name5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2,2-dimethylcyclopentan-1-ol
SMILESCC1(C)CCC(N2CCn3ccnc3C2)C1O
InChIInChI=1S/C13H21N3O/c1-13(2)4-3-10(12(13)17)16-8-7-15-6-5-14-11(15)9-16/h5-6,10,12,17H,3-4,7-9H2,1-2H3
InChIKeySMHWMNQUKXOVMP-UHFFFAOYSA-N
XLogP1.25
TPSA41.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2,2-dimethylcyclopentan-1-ol?
The IUPAC name of 5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2,2-dimethylcyclopentan-1-ol (CID 79857504) is 5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2,2-dimethylcyclopentan-1-ol.
What is the SMILES notation for 5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2,2-dimethylcyclopentan-1-ol?
The canonical SMILES for 5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2,2-dimethylcyclopentan-1-ol is CC1(C)CCC(N2CCn3ccnc3C2)C1O.
What is the InChIKey of 5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2,2-dimethylcyclopentan-1-ol?
The InChIKey is SMHWMNQUKXOVMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-13(2)4-3-10(12(13)17)16-8-7-15-6-5-14-11(15)9-16/h5-6,10,12,17H,3-4,7-9H2,1-2H3.
What are the key properties of 5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2,2-dimethylcyclopentan-1-ol?
5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2,2-dimethylcyclopentan-1-ol has a molecular weight of 235.33 g/mol, XLogP of 1.25, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2,2-dimethylcyclopentan-1-ol is sourced from PubChem (CID 79857504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).