2-[[6-[(2-hydroxyethylamino)methyl]pyrazin-2-yl]methylamino]ethanol

C10H18N4O2 — CID 22457925

IUPAC2-[[6-[(2-hydroxyethylamino)methyl]pyrazin-2-yl]methylamino]ethanol
SMILESOCCNCc1cncc(CNCCO)n1
InChIInChI=1S/C10H18N4O2/c15-3-1-11-5-9-7-13-8-10(14-9)6-12-2-4-16/h7-8,11-12,15-16H,1-6H2
InChIKeyIOYVMKBSMXGBMB-UHFFFAOYSA-N
MW226.28 g/mol
LogP-1.36
Rot. Bonds8

About 2-[[6-[(2-hydroxyethylamino)methyl]pyrazin-2-yl]methylamino]ethanol

2-[[6-[(2-hydroxyethylamino)methyl]pyrazin-2-yl]methylamino]ethanol (PubChem CID 22457925) has the molecular formula C10H18N4O2 and a molecular weight of 226.28 g/mol. Its IUPAC name is 2-[[6-[(2-hydroxyethylamino)methyl]pyrazin-2-yl]methylamino]ethanol.

Molecular Properties

Compound Name2-[[6-[(2-hydroxyethylamino)methyl]pyrazin-2-yl]methylamino]ethanol
PubChem CID22457925
Molecular FormulaC10H18N4O2
Molecular Weight226.28 g/mol
Exact Mass226.14
IUPAC Name2-[[6-[(2-hydroxyethylamino)methyl]pyrazin-2-yl]methylamino]ethanol
SMILESOCCNCc1cncc(CNCCO)n1
InChIInChI=1S/C10H18N4O2/c15-3-1-11-5-9-7-13-8-10(14-9)6-12-2-4-16/h7-8,11-12,15-16H,1-6H2
InChIKeyIOYVMKBSMXGBMB-UHFFFAOYSA-N
XLogP-1.36
TPSA90.30 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 5-1.36
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[[6-[(2-hydroxyethylamino)methyl]pyrazin-2-yl]methylamino]ethanol?
The IUPAC name of 2-[[6-[(2-hydroxyethylamino)methyl]pyrazin-2-yl]methylamino]ethanol (CID 22457925) is 2-[[6-[(2-hydroxyethylamino)methyl]pyrazin-2-yl]methylamino]ethanol.
What is the SMILES notation for 2-[[6-[(2-hydroxyethylamino)methyl]pyrazin-2-yl]methylamino]ethanol?
The canonical SMILES for 2-[[6-[(2-hydroxyethylamino)methyl]pyrazin-2-yl]methylamino]ethanol is OCCNCc1cncc(CNCCO)n1.
What is the InChIKey of 2-[[6-[(2-hydroxyethylamino)methyl]pyrazin-2-yl]methylamino]ethanol?
The InChIKey is IOYVMKBSMXGBMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O2/c15-3-1-11-5-9-7-13-8-10(14-9)6-12-2-4-16/h7-8,11-12,15-16H,1-6H2.
What are the key properties of 2-[[6-[(2-hydroxyethylamino)methyl]pyrazin-2-yl]methylamino]ethanol?
2-[[6-[(2-hydroxyethylamino)methyl]pyrazin-2-yl]methylamino]ethanol has a molecular weight of 226.28 g/mol, XLogP of -1.36, 8 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[6-[(2-hydroxyethylamino)methyl]pyrazin-2-yl]methylamino]ethanol is sourced from PubChem (CID 22457925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).