(1-aminopyrazino[1,2-a]benzimidazol-3-yl)methanol

C11H10N4O — CID 153199692

IUPAC(1-aminopyrazino[1,2-a]benzimidazol-3-yl)methanol
SMILESNc1nc(CO)cn2c1nc1ccccc12
InChIInChI=1S/C11H10N4O/c12-10-11-14-8-3-1-2-4-9(8)15(11)5-7(6-16)13-10/h1-5,16H,6H2,(H2,12,13)
InChIKeyWJRCPNMBNAPFCS-UHFFFAOYSA-N
MW214.23 g/mol
LogP0.96
Rot. Bonds1

About (1-aminopyrazino[1,2-a]benzimidazol-3-yl)methanol

(1-aminopyrazino[1,2-a]benzimidazol-3-yl)methanol (PubChem CID 153199692) has the molecular formula C11H10N4O and a molecular weight of 214.23 g/mol. Its IUPAC name is (1-aminopyrazino[1,2-a]benzimidazol-3-yl)methanol.

Molecular Properties

Compound Name(1-aminopyrazino[1,2-a]benzimidazol-3-yl)methanol
PubChem CID153199692
Molecular FormulaC11H10N4O
Molecular Weight214.23 g/mol
Exact Mass214.09
IUPAC Name(1-aminopyrazino[1,2-a]benzimidazol-3-yl)methanol
SMILESNc1nc(CO)cn2c1nc1ccccc12
InChIInChI=1S/C11H10N4O/c12-10-11-14-8-3-1-2-4-9(8)15(11)5-7(6-16)13-10/h1-5,16H,6H2,(H2,12,13)
InChIKeyWJRCPNMBNAPFCS-UHFFFAOYSA-N
XLogP0.96
TPSA76.44 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.23
LogP ≤ 50.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (1-aminopyrazino[1,2-a]benzimidazol-3-yl)methanol?
The IUPAC name of (1-aminopyrazino[1,2-a]benzimidazol-3-yl)methanol (CID 153199692) is (1-aminopyrazino[1,2-a]benzimidazol-3-yl)methanol.
What is the SMILES notation for (1-aminopyrazino[1,2-a]benzimidazol-3-yl)methanol?
The canonical SMILES for (1-aminopyrazino[1,2-a]benzimidazol-3-yl)methanol is Nc1nc(CO)cn2c1nc1ccccc12.
What is the InChIKey of (1-aminopyrazino[1,2-a]benzimidazol-3-yl)methanol?
The InChIKey is WJRCPNMBNAPFCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N4O/c12-10-11-14-8-3-1-2-4-9(8)15(11)5-7(6-16)13-10/h1-5,16H,6H2,(H2,12,13).
What are the key properties of (1-aminopyrazino[1,2-a]benzimidazol-3-yl)methanol?
(1-aminopyrazino[1,2-a]benzimidazol-3-yl)methanol has a molecular weight of 214.23 g/mol, XLogP of 0.96, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (1-aminopyrazino[1,2-a]benzimidazol-3-yl)methanol is sourced from PubChem (CID 153199692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).