1-(2-methyl-3-pyridinyl)piperazine;dihydrochloride

C10H17Cl2N3 — CID 70057644

IUPAC1-(2-methyl-3-pyridinyl)piperazine;dihydrochloride
SMILESCc1ncccc1N1CCNCC1.Cl.Cl
InChIInChI=1S/C10H15N3.2ClH/c1-9-10(3-2-4-12-9)13-7-5-11-6-8-13;;/h2-4,11H,5-8H2,1H3;2*1H
InChIKeyHSQSIJRJJAQHCZ-UHFFFAOYSA-N
MW250.17 g/mol
LogP1.64
Rot. Bonds1

About 1-(2-methyl-3-pyridinyl)piperazine;dihydrochloride

1-(2-methyl-3-pyridinyl)piperazine;dihydrochloride (PubChem CID 70057644) has the molecular formula C10H17Cl2N3 and a molecular weight of 250.17 g/mol. Its IUPAC name is 1-(2-methyl-3-pyridinyl)piperazine;dihydrochloride.

Molecular Properties

Compound Name1-(2-methyl-3-pyridinyl)piperazine;dihydrochloride
PubChem CID70057644
Molecular FormulaC10H17Cl2N3
Molecular Weight250.17 g/mol
Exact Mass249.08
IUPAC Name1-(2-methyl-3-pyridinyl)piperazine;dihydrochloride
SMILESCc1ncccc1N1CCNCC1.Cl.Cl
InChIInChI=1S/C10H15N3.2ClH/c1-9-10(3-2-4-12-9)13-7-5-11-6-8-13;;/h2-4,11H,5-8H2,1H3;2*1H
InChIKeyHSQSIJRJJAQHCZ-UHFFFAOYSA-N
XLogP1.64
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.17
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(aziridin-1-yl)-2-methylpyridine
CID 54398386
tert-butyl formate;1-(2-methyl-3-pyridinyl)piperazine
CID 174649471
1-(3-methyl-2-pyridinyl)piperazine
CID 2760057
5-piperazin-1-ylquinoline
CID 10656226
(2-piperazin-1-yl-3-pyridinyl)boronic acid
CID 53445093
2-ethyl-1-(2-methyl-3-pyridinyl)piperazine
CID 79044286
1-(2-piperazin-1-ylphenyl)piperazine;hydrobromide
CID 118703673
3-(2-methylpropyl)-1-(2-methyl-3-pyridinyl)piperazine
CID 79043174
1-[2-(difluoromethoxy)-3-pyridinyl]piperazine
CID 139512635
1-[2-(2-phenylethyl)-3-pyridinyl]piperazine
CID 173128049
4-piperazin-1-yl-1,5-naphthyridine
CID 57013367
[1-(2-methyl-3-pyridinyl)pyrrolidin-3-yl]methanol
CID 79044202

Frequently Asked Questions

What is the IUPAC name of 1-(2-methyl-3-pyridinyl)piperazine;dihydrochloride?
The IUPAC name of 1-(2-methyl-3-pyridinyl)piperazine;dihydrochloride (CID 70057644) is 1-(2-methyl-3-pyridinyl)piperazine;dihydrochloride.
What is the SMILES notation for 1-(2-methyl-3-pyridinyl)piperazine;dihydrochloride?
The canonical SMILES for 1-(2-methyl-3-pyridinyl)piperazine;dihydrochloride is Cc1ncccc1N1CCNCC1.Cl.Cl.
What is the InChIKey of 1-(2-methyl-3-pyridinyl)piperazine;dihydrochloride?
The InChIKey is HSQSIJRJJAQHCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3.2ClH/c1-9-10(3-2-4-12-9)13-7-5-11-6-8-13;;/h2-4,11H,5-8H2,1H3;2*1H.
What are the key properties of 1-(2-methyl-3-pyridinyl)piperazine;dihydrochloride?
1-(2-methyl-3-pyridinyl)piperazine;dihydrochloride has a molecular weight of 250.17 g/mol, XLogP of 1.64, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methyl-3-pyridinyl)piperazine;dihydrochloride is sourced from PubChem (CID 70057644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).