[1-[6-(ethylamino)pyrazin-2-yl]piperidin-4-yl]methanol

C12H20N4O — CID 78990217

IUPAC[1-[6-(ethylamino)pyrazin-2-yl]piperidin-4-yl]methanol
SMILESCCNc1cncc(N2CCC(CO)CC2)n1
InChIInChI=1S/C12H20N4O/c1-2-14-11-7-13-8-12(15-11)16-5-3-10(9-17)4-6-16/h7-8,10,17H,2-6,9H2,1H3,(H,14,15)
InChIKeyZGHQLFDDGKLJAQ-UHFFFAOYSA-N
MW236.32 g/mol
LogP1.12
Rot. Bonds4

About [1-[6-(ethylamino)pyrazin-2-yl]piperidin-4-yl]methanol

[1-[6-(ethylamino)pyrazin-2-yl]piperidin-4-yl]methanol (PubChem CID 78990217) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is [1-[6-(ethylamino)pyrazin-2-yl]piperidin-4-yl]methanol.

Molecular Properties

Compound Name[1-[6-(ethylamino)pyrazin-2-yl]piperidin-4-yl]methanol
PubChem CID78990217
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC Name[1-[6-(ethylamino)pyrazin-2-yl]piperidin-4-yl]methanol
SMILESCCNc1cncc(N2CCC(CO)CC2)n1
InChIInChI=1S/C12H20N4O/c1-2-14-11-7-13-8-12(15-11)16-5-3-10(9-17)4-6-16/h7-8,10,17H,2-6,9H2,1H3,(H,14,15)
InChIKeyZGHQLFDDGKLJAQ-UHFFFAOYSA-N
XLogP1.12
TPSA61.28 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [1-[6-(ethylamino)pyrazin-2-yl]piperidin-4-yl]methanol?
The IUPAC name of [1-[6-(ethylamino)pyrazin-2-yl]piperidin-4-yl]methanol (CID 78990217) is [1-[6-(ethylamino)pyrazin-2-yl]piperidin-4-yl]methanol.
What is the SMILES notation for [1-[6-(ethylamino)pyrazin-2-yl]piperidin-4-yl]methanol?
The canonical SMILES for [1-[6-(ethylamino)pyrazin-2-yl]piperidin-4-yl]methanol is CCNc1cncc(N2CCC(CO)CC2)n1.
What is the InChIKey of [1-[6-(ethylamino)pyrazin-2-yl]piperidin-4-yl]methanol?
The InChIKey is ZGHQLFDDGKLJAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c1-2-14-11-7-13-8-12(15-11)16-5-3-10(9-17)4-6-16/h7-8,10,17H,2-6,9H2,1H3,(H,14,15).
What are the key properties of [1-[6-(ethylamino)pyrazin-2-yl]piperidin-4-yl]methanol?
[1-[6-(ethylamino)pyrazin-2-yl]piperidin-4-yl]methanol has a molecular weight of 236.32 g/mol, XLogP of 1.12, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[6-(ethylamino)pyrazin-2-yl]piperidin-4-yl]methanol is sourced from PubChem (CID 78990217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).