2-pyridin-2-yl-2-(3,3,4-trimethylpiperazin-1-yl)ethanamine

C14H24N4 — CID 63603481

IUPAC2-pyridin-2-yl-2-(3,3,4-trimethylpiperazin-1-yl)ethanamine
SMILESCN1CCN(C(CN)c2ccccn2)CC1(C)C
InChIInChI=1S/C14H24N4/c1-14(2)11-18(9-8-17(14)3)13(10-15)12-6-4-5-7-16-12/h4-7,13H,8-11,15H2,1-3H3
InChIKeyIXHYZUBBYMRGSC-UHFFFAOYSA-N
MW248.37 g/mol
LogP1.11
Rot. Bonds3

About 2-pyridin-2-yl-2-(3,3,4-trimethylpiperazin-1-yl)ethanamine

2-pyridin-2-yl-2-(3,3,4-trimethylpiperazin-1-yl)ethanamine (PubChem CID 63603481) has the molecular formula C14H24N4 and a molecular weight of 248.37 g/mol. Its IUPAC name is 2-pyridin-2-yl-2-(3,3,4-trimethylpiperazin-1-yl)ethanamine.

Molecular Properties

Compound Name2-pyridin-2-yl-2-(3,3,4-trimethylpiperazin-1-yl)ethanamine
PubChem CID63603481
Molecular FormulaC14H24N4
Molecular Weight248.37 g/mol
Exact Mass248.20
IUPAC Name2-pyridin-2-yl-2-(3,3,4-trimethylpiperazin-1-yl)ethanamine
SMILESCN1CCN(C(CN)c2ccccn2)CC1(C)C
InChIInChI=1S/C14H24N4/c1-14(2)11-18(9-8-17(14)3)13(10-15)12-6-4-5-7-16-12/h4-7,13H,8-11,15H2,1-3H3
InChIKeyIXHYZUBBYMRGSC-UHFFFAOYSA-N
XLogP1.11
TPSA45.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-pyridin-2-yl-1-(3,3,4-trimethylpiperazin-1-yl)propan-2-amine
CID 55217333
1-pyridin-2-yl-1-(3,3,4-trimethylpiperazin-1-yl)butan-2-amine
CID 63604175
1-(2-amino-1-pyridin-2-ylethyl)-N,3-dimethylpyrrolidine-3-carboxamide
CID 106317859
2-pyridin-2-yl-2-(3,4,5-trimethylpiperazin-1-yl)ethanamine
CID 114537050
2-(3-phenylpyrrolidin-1-yl)-2-pyridin-2-ylethanamine
CID 62132461
2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-2-pyridin-2-ylethanamine
CID 66391868
2-[1-(3,3,4-trimethylpiperazin-1-yl)propyl]phenol
CID 82980842
2-(3-ethoxypiperidin-1-yl)-2-pyridin-2-ylethanamine
CID 54985578
2-pyridin-2-ylpropan-1-amine
CID 21481533
2-(4-chloro-3,5-dimethylpyrazol-1-yl)-2-pyridin-2-ylethanamine
CID 62131019
2-[4-[phenyl(pyridin-2-yl)methyl]piperazin-1-yl]ethanamine
CID 19370276
1-(4-ethyl-4-methylpiperidin-1-yl)-1-pyridin-2-ylpropan-2-amine
CID 55166215

Frequently Asked Questions

What is the IUPAC name of 2-pyridin-2-yl-2-(3,3,4-trimethylpiperazin-1-yl)ethanamine?
The IUPAC name of 2-pyridin-2-yl-2-(3,3,4-trimethylpiperazin-1-yl)ethanamine (CID 63603481) is 2-pyridin-2-yl-2-(3,3,4-trimethylpiperazin-1-yl)ethanamine.
What is the SMILES notation for 2-pyridin-2-yl-2-(3,3,4-trimethylpiperazin-1-yl)ethanamine?
The canonical SMILES for 2-pyridin-2-yl-2-(3,3,4-trimethylpiperazin-1-yl)ethanamine is CN1CCN(C(CN)c2ccccn2)CC1(C)C.
What is the InChIKey of 2-pyridin-2-yl-2-(3,3,4-trimethylpiperazin-1-yl)ethanamine?
The InChIKey is IXHYZUBBYMRGSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4/c1-14(2)11-18(9-8-17(14)3)13(10-15)12-6-4-5-7-16-12/h4-7,13H,8-11,15H2,1-3H3.
What are the key properties of 2-pyridin-2-yl-2-(3,3,4-trimethylpiperazin-1-yl)ethanamine?
2-pyridin-2-yl-2-(3,3,4-trimethylpiperazin-1-yl)ethanamine has a molecular weight of 248.37 g/mol, XLogP of 1.11, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyridin-2-yl-2-(3,3,4-trimethylpiperazin-1-yl)ethanamine is sourced from PubChem (CID 63603481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).