[4-amino-1-(5-fluoropyrazin-2-yl)piperidin-4-yl]methanol

C10H15FN4O — CID 166243495

IUPAC[4-amino-1-(5-fluoropyrazin-2-yl)piperidin-4-yl]methanol
SMILESNC1(CO)CCN(c2cnc(F)cn2)CC1
InChIInChI=1S/C10H15FN4O/c11-8-5-14-9(6-13-8)15-3-1-10(12,7-16)2-4-15/h5-6,16H,1-4,7,12H2
InChIKeyPAIUZZURRRWJJD-UHFFFAOYSA-N
MW226.25 g/mol
LogP-0.09
Rot. Bonds2

About [4-amino-1-(5-fluoropyrazin-2-yl)piperidin-4-yl]methanol

[4-amino-1-(5-fluoropyrazin-2-yl)piperidin-4-yl]methanol (PubChem CID 166243495) has the molecular formula C10H15FN4O and a molecular weight of 226.25 g/mol. Its IUPAC name is [4-amino-1-(5-fluoropyrazin-2-yl)piperidin-4-yl]methanol.

Molecular Properties

Compound Name[4-amino-1-(5-fluoropyrazin-2-yl)piperidin-4-yl]methanol
PubChem CID166243495
Molecular FormulaC10H15FN4O
Molecular Weight226.25 g/mol
Exact Mass226.12
IUPAC Name[4-amino-1-(5-fluoropyrazin-2-yl)piperidin-4-yl]methanol
SMILESNC1(CO)CCN(c2cnc(F)cn2)CC1
InChIInChI=1S/C10H15FN4O/c11-8-5-14-9(6-13-8)15-3-1-10(12,7-16)2-4-15/h5-6,16H,1-4,7,12H2
InChIKeyPAIUZZURRRWJJD-UHFFFAOYSA-N
XLogP-0.09
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.25
LogP ≤ 5-0.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [4-amino-1-(5-fluoropyrazin-2-yl)piperidin-4-yl]methanol?
The IUPAC name of [4-amino-1-(5-fluoropyrazin-2-yl)piperidin-4-yl]methanol (CID 166243495) is [4-amino-1-(5-fluoropyrazin-2-yl)piperidin-4-yl]methanol.
What is the SMILES notation for [4-amino-1-(5-fluoropyrazin-2-yl)piperidin-4-yl]methanol?
The canonical SMILES for [4-amino-1-(5-fluoropyrazin-2-yl)piperidin-4-yl]methanol is NC1(CO)CCN(c2cnc(F)cn2)CC1.
What is the InChIKey of [4-amino-1-(5-fluoropyrazin-2-yl)piperidin-4-yl]methanol?
The InChIKey is PAIUZZURRRWJJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15FN4O/c11-8-5-14-9(6-13-8)15-3-1-10(12,7-16)2-4-15/h5-6,16H,1-4,7,12H2.
What are the key properties of [4-amino-1-(5-fluoropyrazin-2-yl)piperidin-4-yl]methanol?
[4-amino-1-(5-fluoropyrazin-2-yl)piperidin-4-yl]methanol has a molecular weight of 226.25 g/mol, XLogP of -0.09, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-amino-1-(5-fluoropyrazin-2-yl)piperidin-4-yl]methanol is sourced from PubChem (CID 166243495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).