2-[1-[3-(aminomethyl)pyrazin-2-yl]piperidin-3-yl]ethanol

C12H20N4O — CID 107227067

IUPAC2-[1-[3-(aminomethyl)pyrazin-2-yl]piperidin-3-yl]ethanol
SMILESNCc1nccnc1N1CCCC(CCO)C1
InChIInChI=1S/C12H20N4O/c13-8-11-12(15-5-4-14-11)16-6-1-2-10(9-16)3-7-17/h4-5,10,17H,1-3,6-9,13H2
InChIKeyVYUXVVNMGNUFAI-UHFFFAOYSA-N
MW236.32 g/mol
LogP0.53
Rot. Bonds4

About 2-[1-[3-(aminomethyl)pyrazin-2-yl]piperidin-3-yl]ethanol

2-[1-[3-(aminomethyl)pyrazin-2-yl]piperidin-3-yl]ethanol (PubChem CID 107227067) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is 2-[1-[3-(aminomethyl)pyrazin-2-yl]piperidin-3-yl]ethanol.

Molecular Properties

Compound Name2-[1-[3-(aminomethyl)pyrazin-2-yl]piperidin-3-yl]ethanol
PubChem CID107227067
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC Name2-[1-[3-(aminomethyl)pyrazin-2-yl]piperidin-3-yl]ethanol
SMILESNCc1nccnc1N1CCCC(CCO)C1
InChIInChI=1S/C12H20N4O/c13-8-11-12(15-5-4-14-11)16-6-1-2-10(9-16)3-7-17/h4-5,10,17H,1-3,6-9,13H2
InChIKeyVYUXVVNMGNUFAI-UHFFFAOYSA-N
XLogP0.53
TPSA75.27 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 ≤ 50.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[1-[6-(aminomethyl)-3-pyridinyl]piperidin-3-yl]ethanol
CID 107227098
2-[1-(3-methylpyrazin-2-yl)piperidin-3-yl]ethanamine
CID 83065103
[3-(3-ethoxypiperidin-1-yl)pyrazin-2-yl]methanamine
CID 62673049
2-[1-(1-methylimidazo[4,5-c]pyridin-4-yl)piperidin-3-yl]ethanol
CID 103386158
2-[1-[3-(aminomethyl)-6-(trifluoromethyl)-2-pyridinyl]piperidin-3-yl]ethanol
CID 107227096
2-[1-(6-amino-5-bromopyrimidin-4-yl)piperidin-3-yl]ethanol
CID 114072871
2-[1-(6-amino-5-methylpyrimidin-4-yl)piperidin-3-yl]ethanol
CID 107229203
2-[1-(3-ethoxy-2-pyridinyl)piperidin-3-yl]ethanol
CID 113371177
2-[1-[4-(aminomethyl)phenyl]piperidin-3-yl]ethanol
CID 107227081
2-[1-(5-amino-3-methyl-2-pyridinyl)piperidin-3-yl]ethanol
CID 107226933
2-[1-[5-(aminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]piperidin-3-yl]ethanol
CID 107228114
2-[1-(3-nitro-2-pyridinyl)piperidin-3-yl]ethanol
CID 55064569

Frequently Asked Questions

What is the IUPAC name of 2-[1-[3-(aminomethyl)pyrazin-2-yl]piperidin-3-yl]ethanol?
The IUPAC name of 2-[1-[3-(aminomethyl)pyrazin-2-yl]piperidin-3-yl]ethanol (CID 107227067) is 2-[1-[3-(aminomethyl)pyrazin-2-yl]piperidin-3-yl]ethanol.
What is the SMILES notation for 2-[1-[3-(aminomethyl)pyrazin-2-yl]piperidin-3-yl]ethanol?
The canonical SMILES for 2-[1-[3-(aminomethyl)pyrazin-2-yl]piperidin-3-yl]ethanol is NCc1nccnc1N1CCCC(CCO)C1.
What is the InChIKey of 2-[1-[3-(aminomethyl)pyrazin-2-yl]piperidin-3-yl]ethanol?
The InChIKey is VYUXVVNMGNUFAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c13-8-11-12(15-5-4-14-11)16-6-1-2-10(9-16)3-7-17/h4-5,10,17H,1-3,6-9,13H2.
What are the key properties of 2-[1-[3-(aminomethyl)pyrazin-2-yl]piperidin-3-yl]ethanol?
2-[1-[3-(aminomethyl)pyrazin-2-yl]piperidin-3-yl]ethanol has a molecular weight of 236.32 g/mol, XLogP of 0.53, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[3-(aminomethyl)pyrazin-2-yl]piperidin-3-yl]ethanol is sourced from PubChem (CID 107227067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).