5-[(3-ethoxypiperidin-1-yl)methyl]pyrazin-2-amine

C12H20N4O — CID 103056225

IUPAC5-[(3-ethoxypiperidin-1-yl)methyl]pyrazin-2-amine
SMILESCCOC1CCCN(Cc2cnc(N)cn2)C1
InChIInChI=1S/C12H20N4O/c1-2-17-11-4-3-5-16(9-11)8-10-6-15-12(13)7-14-10/h6-7,11H,2-5,8-9H2,1H3,(H2,13,15)
InChIKeyGCIXPXMJXIJBRM-UHFFFAOYSA-N
MW236.32 g/mol
LogP1.06
Rot. Bonds4

About 5-[(3-ethoxypiperidin-1-yl)methyl]pyrazin-2-amine

5-[(3-ethoxypiperidin-1-yl)methyl]pyrazin-2-amine (PubChem CID 103056225) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is 5-[(3-ethoxypiperidin-1-yl)methyl]pyrazin-2-amine.

Molecular Properties

Compound Name5-[(3-ethoxypiperidin-1-yl)methyl]pyrazin-2-amine
PubChem CID103056225
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC Name5-[(3-ethoxypiperidin-1-yl)methyl]pyrazin-2-amine
SMILESCCOC1CCCN(Cc2cnc(N)cn2)C1
InChIInChI=1S/C12H20N4O/c1-2-17-11-4-3-5-16(9-11)8-10-6-15-12(13)7-14-10/h6-7,11H,2-5,8-9H2,1H3,(H2,13,15)
InChIKeyGCIXPXMJXIJBRM-UHFFFAOYSA-N
XLogP1.06
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[[(3S)-3-ethoxypiperidin-1-yl]methyl]pyridine
CID 95632872
N-ethyl-5-[(3-propoxypiperidin-1-yl)methyl]pyrazin-2-amine
CID 103056216
6-[(3-methoxypiperidin-1-yl)methyl]pyridin-3-amine
CID 102963724
5-[(4-ethylpiperazin-1-yl)methyl]pyrazin-2-amine
CID 103055404
2-[1-[(5-aminopyrazin-2-yl)methyl]piperidin-4-yl]oxyethanol
CID 103056754
5-[[4-(methoxymethyl)piperidin-1-yl]methyl]pyrazin-2-amine
CID 103056498
5-[(3,4,5-trimethylpiperazin-1-yl)methyl]pyrazin-2-amine
CID 103056908
5-[(3-ethoxypiperidin-1-yl)methyl]-N-propylpyridin-2-amine
CID 62207953
5-(cyclobutyloxymethyl)pyrazin-2-amine
CID 103058850
[5-[(3-ethoxypiperidin-1-yl)methyl]-3-methylfuran-2-yl]methanamine
CID 62411388
5-[(3-ethoxypiperidin-1-yl)methyl]-2-methoxyaniline
CID 54985085
2-(3-ethoxypiperidin-1-yl)-1-(1-methylpyrazol-4-yl)ethanamine
CID 115291229

Frequently Asked Questions

What is the IUPAC name of 5-[(3-ethoxypiperidin-1-yl)methyl]pyrazin-2-amine?
The IUPAC name of 5-[(3-ethoxypiperidin-1-yl)methyl]pyrazin-2-amine (CID 103056225) is 5-[(3-ethoxypiperidin-1-yl)methyl]pyrazin-2-amine.
What is the SMILES notation for 5-[(3-ethoxypiperidin-1-yl)methyl]pyrazin-2-amine?
The canonical SMILES for 5-[(3-ethoxypiperidin-1-yl)methyl]pyrazin-2-amine is CCOC1CCCN(Cc2cnc(N)cn2)C1.
What is the InChIKey of 5-[(3-ethoxypiperidin-1-yl)methyl]pyrazin-2-amine?
The InChIKey is GCIXPXMJXIJBRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c1-2-17-11-4-3-5-16(9-11)8-10-6-15-12(13)7-14-10/h6-7,11H,2-5,8-9H2,1H3,(H2,13,15).
What are the key properties of 5-[(3-ethoxypiperidin-1-yl)methyl]pyrazin-2-amine?
5-[(3-ethoxypiperidin-1-yl)methyl]pyrazin-2-amine has a molecular weight of 236.32 g/mol, XLogP of 1.06, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(3-ethoxypiperidin-1-yl)methyl]pyrazin-2-amine is sourced from PubChem (CID 103056225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).