2-[methyl-(2-piperazin-1-yl-1-pyridin-3-ylethyl)amino]ethanol

C14H24N4O — CID 82201784

IUPAC2-[methyl-(2-piperazin-1-yl-1-pyridin-3-ylethyl)amino]ethanol
SMILESCN(CCO)C(CN1CCNCC1)c1cccnc1
InChIInChI=1S/C14H24N4O/c1-17(9-10-19)14(13-3-2-4-16-11-13)12-18-7-5-15-6-8-18/h2-4,11,14-15,19H,5-10,12H2,1H3
InChIKeyWLBMFRFOMKGDGW-UHFFFAOYSA-N
MW264.37 g/mol
LogP-0.05
Rot. Bonds6

About 2-[methyl-(2-piperazin-1-yl-1-pyridin-3-ylethyl)amino]ethanol

2-[methyl-(2-piperazin-1-yl-1-pyridin-3-ylethyl)amino]ethanol (PubChem CID 82201784) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is 2-[methyl-(2-piperazin-1-yl-1-pyridin-3-ylethyl)amino]ethanol.

Molecular Properties

Compound Name2-[methyl-(2-piperazin-1-yl-1-pyridin-3-ylethyl)amino]ethanol
PubChem CID82201784
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name2-[methyl-(2-piperazin-1-yl-1-pyridin-3-ylethyl)amino]ethanol
SMILESCN(CCO)C(CN1CCNCC1)c1cccnc1
InChIInChI=1S/C14H24N4O/c1-17(9-10-19)14(13-3-2-4-16-11-13)12-18-7-5-15-6-8-18/h2-4,11,14-15,19H,5-10,12H2,1H3
InChIKeyWLBMFRFOMKGDGW-UHFFFAOYSA-N
XLogP-0.05
TPSA51.63 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 5-0.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N,N-diethyl-2-piperazin-1-yl-1-pyridin-3-ylethanamine
CID 82201783
1-[(2R)-2-pyridin-3-ylpropyl]piperazine
CID 67593511
1-(2-piperazin-1-yl-1-pyridin-3-ylethyl)azepane
CID 82201767
N-methyl-1-pyridin-3-yl-N-(2-pyrrolidin-1-ylethyl)ethane-1,2-diamine
CID 63207068
N-[1-(3-methoxyphenyl)-2-piperazin-1-ylethyl]-N-methylbutan-1-amine
CID 82201727
2-(dimethylamino)-2-pyridin-3-ylethanol
CID 54775729
1-(2-piperazin-1-yl-2-pyridin-3-ylethyl)piperidin-4-ol
CID 83978977
1-[(1S)-1-pyridin-3-ylpropyl]piperazine
CID 92764058
1-piperazin-1-yl-1-pyridin-3-ylpropan-2-ol
CID 82286657
N-methyl-N-(4-piperazin-1-ylbutyl)pyridin-3-amine
CID 115240359
2-[ethyl-(2-piperazin-1-yl-1-thiophen-2-ylethyl)amino]ethanol
CID 82201748
1-piperazin-1-yl-3-pyridin-3-ylbutan-1-one
CID 82510316

Frequently Asked Questions

What is the IUPAC name of 2-[methyl-(2-piperazin-1-yl-1-pyridin-3-ylethyl)amino]ethanol?
The IUPAC name of 2-[methyl-(2-piperazin-1-yl-1-pyridin-3-ylethyl)amino]ethanol (CID 82201784) is 2-[methyl-(2-piperazin-1-yl-1-pyridin-3-ylethyl)amino]ethanol.
What is the SMILES notation for 2-[methyl-(2-piperazin-1-yl-1-pyridin-3-ylethyl)amino]ethanol?
The canonical SMILES for 2-[methyl-(2-piperazin-1-yl-1-pyridin-3-ylethyl)amino]ethanol is CN(CCO)C(CN1CCNCC1)c1cccnc1.
What is the InChIKey of 2-[methyl-(2-piperazin-1-yl-1-pyridin-3-ylethyl)amino]ethanol?
The InChIKey is WLBMFRFOMKGDGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-17(9-10-19)14(13-3-2-4-16-11-13)12-18-7-5-15-6-8-18/h2-4,11,14-15,19H,5-10,12H2,1H3.
What are the key properties of 2-[methyl-(2-piperazin-1-yl-1-pyridin-3-ylethyl)amino]ethanol?
2-[methyl-(2-piperazin-1-yl-1-pyridin-3-ylethyl)amino]ethanol has a molecular weight of 264.37 g/mol, XLogP of -0.05, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl-(2-piperazin-1-yl-1-pyridin-3-ylethyl)amino]ethanol is sourced from PubChem (CID 82201784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).