1-(1-methyl-2H-pyridin-6-yl)piperazine

C10H17N3 — CID 56626623

IUPAC1-(1-methyl-2H-pyridin-6-yl)piperazine
SMILESCN1CC=CC=C1N1CCNCC1
InChIInChI=1S/C10H17N3/c1-12-7-3-2-4-10(12)13-8-5-11-6-9-13/h2-4,11H,5-9H2,1H3
InChIKeyKBMXCMREUKVSID-UHFFFAOYSA-N
MW179.27 g/mol
LogP0.23
Rot. Bonds1

About 1-(1-methyl-2H-pyridin-6-yl)piperazine

1-(1-methyl-2H-pyridin-6-yl)piperazine (PubChem CID 56626623) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is 1-(1-methyl-2H-pyridin-6-yl)piperazine.

Molecular Properties

Compound Name1-(1-methyl-2H-pyridin-6-yl)piperazine
PubChem CID56626623
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC Name1-(1-methyl-2H-pyridin-6-yl)piperazine
SMILESCN1CC=CC=C1N1CCNCC1
InChIInChI=1S/C10H17N3/c1-12-7-3-2-4-10(12)13-8-5-11-6-9-13/h2-4,11H,5-9H2,1H3
InChIKeyKBMXCMREUKVSID-UHFFFAOYSA-N
XLogP0.23
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 50.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-methyl-6-pyrrolidin-1-yl-2H-pyridine
CID 56609190
2-piperazin-1-yl-4,6-bis(2H-pyridin-1-yl)-1,3,5-triazine
CID 23172417
1H-azepine;2-phenyl-1-piperazin-1-yl-3,5-dihydro-[1,2,4]triazolo[4,3-a]pyridine
CID 157420069
1-(1-methylpyrrol-2-yl)piperazine
CID 96740431
1-methyl-7-piperazin-1-yl-2,3-dihydroindole
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1-(2-piperazin-1-ylphenyl)piperazine;hydrobromide
CID 118703673
1-(2-propan-2-ylphenyl)piperazine
CID 3608822
5-methyl-4-piperazin-1-yl-6H-pteridine
CID 176729393
ethane;molecular hydrogen;1-phenylpiperazine
CID 144544571
ethane;1-(4-piperazin-1-ylphenyl)ethanone
CID 142085748
N,N-dimethyl-4-piperazin-1-ylaniline
CID 4738754
1-(3,5-dimethoxyphenyl)piperazine
CID 2736205

Frequently Asked Questions

What is the IUPAC name of 1-(1-methyl-2H-pyridin-6-yl)piperazine?
The IUPAC name of 1-(1-methyl-2H-pyridin-6-yl)piperazine (CID 56626623) is 1-(1-methyl-2H-pyridin-6-yl)piperazine.
What is the SMILES notation for 1-(1-methyl-2H-pyridin-6-yl)piperazine?
The canonical SMILES for 1-(1-methyl-2H-pyridin-6-yl)piperazine is CN1CC=CC=C1N1CCNCC1.
What is the InChIKey of 1-(1-methyl-2H-pyridin-6-yl)piperazine?
The InChIKey is KBMXCMREUKVSID-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-12-7-3-2-4-10(12)13-8-5-11-6-9-13/h2-4,11H,5-9H2,1H3.
What are the key properties of 1-(1-methyl-2H-pyridin-6-yl)piperazine?
1-(1-methyl-2H-pyridin-6-yl)piperazine has a molecular weight of 179.27 g/mol, XLogP of 0.23, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methyl-2H-pyridin-6-yl)piperazine is sourced from PubChem (CID 56626623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).