N-[[5-(3-ethylpiperidin-1-yl)pyrazin-2-yl]methyl]-2-methylpropan-2-amine

C16H28N4 — CID 107379243

IUPACN-[[5-(3-ethylpiperidin-1-yl)pyrazin-2-yl]methyl]-2-methylpropan-2-amine
SMILESCCC1CCCN(c2cnc(CNC(C)(C)C)cn2)C1
InChIInChI=1S/C16H28N4/c1-5-13-7-6-8-20(12-13)15-11-17-14(9-18-15)10-19-16(2,3)4/h9,11,13,19H,5-8,10,12H2,1-4H3
InChIKeyQYYJMDCEEYYAOO-UHFFFAOYSA-N
MW276.43 g/mol
LogP2.99
Rot. Bonds4

About N-[[5-(3-ethylpiperidin-1-yl)pyrazin-2-yl]methyl]-2-methylpropan-2-amine

N-[[5-(3-ethylpiperidin-1-yl)pyrazin-2-yl]methyl]-2-methylpropan-2-amine (PubChem CID 107379243) has the molecular formula C16H28N4 and a molecular weight of 276.43 g/mol. Its IUPAC name is N-[[5-(3-ethylpiperidin-1-yl)pyrazin-2-yl]methyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[[5-(3-ethylpiperidin-1-yl)pyrazin-2-yl]methyl]-2-methylpropan-2-amine
PubChem CID107379243
Molecular FormulaC16H28N4
Molecular Weight276.43 g/mol
Exact Mass276.23
IUPAC NameN-[[5-(3-ethylpiperidin-1-yl)pyrazin-2-yl]methyl]-2-methylpropan-2-amine
SMILESCCC1CCCN(c2cnc(CNC(C)(C)C)cn2)C1
InChIInChI=1S/C16H28N4/c1-5-13-7-6-8-20(12-13)15-11-17-14(9-18-15)10-19-16(2,3)4/h9,11,13,19H,5-8,10,12H2,1-4H3
InChIKeyQYYJMDCEEYYAOO-UHFFFAOYSA-N
XLogP2.99
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.43
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[5-(3-tert-butylpyrrolidin-1-yl)pyrazin-2-yl]methyl]-2-methylpropan-2-amine
CID 107380836
N-[[5-(2-ethylpyrrolidin-1-yl)pyrazin-2-yl]methyl]-2-methylpropan-2-amine
CID 107378795
5-(3-ethylpiperidin-1-yl)pyrazin-2-amine
CID 80652769
N-[[5-(3,5-dimethylpiperidin-1-yl)pyrazin-2-yl]methyl]-2-methylpropan-2-amine
CID 107378958
N-methyl-1-[5-(3-methylpiperidin-1-yl)pyrazin-2-yl]methanamine
CID 107378854
2-(3-ethylpiperidin-1-yl)pyrazine
CID 146424567
N-[[2-(3-ethylpiperidin-1-yl)phenyl]methyl]-2-methylpropan-2-amine
CID 63058978
[1-[5-(hydroxymethyl)pyrazin-2-yl]piperidin-3-yl]methanol
CID 107372633
N-[[5-(4-ethyl-4-methylpiperidin-1-yl)pyrazin-2-yl]methyl]-2-methylpropan-2-amine
CID 107380091
N-[[5-(3-ethylpiperidin-1-yl)-1,3,4-oxadiazol-2-yl]methyl]-2-methylpropan-2-amine
CID 106969286
N-[[5-(3-propylpyrrolidin-1-yl)pyrazin-2-yl]methyl]propan-2-amine
CID 107380849
[6-(3-ethylpiperidin-1-yl)-3-pyridinyl]methanol
CID 61256877

Frequently Asked Questions

What is the IUPAC name of N-[[5-(3-ethylpiperidin-1-yl)pyrazin-2-yl]methyl]-2-methylpropan-2-amine?
The IUPAC name of N-[[5-(3-ethylpiperidin-1-yl)pyrazin-2-yl]methyl]-2-methylpropan-2-amine (CID 107379243) is N-[[5-(3-ethylpiperidin-1-yl)pyrazin-2-yl]methyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[[5-(3-ethylpiperidin-1-yl)pyrazin-2-yl]methyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[[5-(3-ethylpiperidin-1-yl)pyrazin-2-yl]methyl]-2-methylpropan-2-amine is CCC1CCCN(c2cnc(CNC(C)(C)C)cn2)C1.
What is the InChIKey of N-[[5-(3-ethylpiperidin-1-yl)pyrazin-2-yl]methyl]-2-methylpropan-2-amine?
The InChIKey is QYYJMDCEEYYAOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N4/c1-5-13-7-6-8-20(12-13)15-11-17-14(9-18-15)10-19-16(2,3)4/h9,11,13,19H,5-8,10,12H2,1-4H3.
What are the key properties of N-[[5-(3-ethylpiperidin-1-yl)pyrazin-2-yl]methyl]-2-methylpropan-2-amine?
N-[[5-(3-ethylpiperidin-1-yl)pyrazin-2-yl]methyl]-2-methylpropan-2-amine has a molecular weight of 276.43 g/mol, XLogP of 2.99, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(3-ethylpiperidin-1-yl)pyrazin-2-yl]methyl]-2-methylpropan-2-amine is sourced from PubChem (CID 107379243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).