1-(3-chloro-2-pyridinyl)-4-methylpiperazine

C10H14ClN3 — CID 11959098

IUPAC1-(3-chloro-2-pyridinyl)-4-methylpiperazine
SMILESCN1CCN(c2ncccc2Cl)CC1
InChIInChI=1S/C10H14ClN3/c1-13-5-7-14(8-6-13)10-9(11)3-2-4-12-10/h2-4H,5-8H2,1H3
InChIKeyFNMDXKBBBVNQQT-UHFFFAOYSA-N
MW211.70 g/mol
LogP1.49
Rot. Bonds1

About 1-(3-chloro-2-pyridinyl)-4-methylpiperazine

1-(3-chloro-2-pyridinyl)-4-methylpiperazine (PubChem CID 11959098) has the molecular formula C10H14ClN3 and a molecular weight of 211.70 g/mol. Its IUPAC name is 1-(3-chloro-2-pyridinyl)-4-methylpiperazine.

Molecular Properties

Compound Name1-(3-chloro-2-pyridinyl)-4-methylpiperazine
PubChem CID11959098
Molecular FormulaC10H14ClN3
Molecular Weight211.70 g/mol
Exact Mass211.09
IUPAC Name1-(3-chloro-2-pyridinyl)-4-methylpiperazine
SMILESCN1CCN(c2ncccc2Cl)CC1
InChIInChI=1S/C10H14ClN3/c1-13-5-7-14(8-6-13)10-9(11)3-2-4-12-10/h2-4H,5-8H2,1H3
InChIKeyFNMDXKBBBVNQQT-UHFFFAOYSA-N
XLogP1.49
TPSA19.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.70
LogP ≤ 51.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

Chloropyramine
CID 25295
Chloropyramine Hydrochloride
CID 80311
1-(6-Chloro-2-pyridinyl)-4-piperidinamine hydrochloride
CID 131746
1-(2-Pyridyl)piperazine
CID 94459
1-(6-Chloro-2-pyridinyl)-4-piperidinamine
CID 131747
2-Dimethylaminopyridine
CID 21885
2-Amino-5-chloropyridine
CID 66174
N2-(4-chlorophenyl)pyridine-2,3-diamine
CID 12445422
N1,N1-Dimethyl-N2-2-pyridinyl-1,2-ethanediamine
CID 90273
2-Amino-3-chloropyridine
CID 693267
1-(3-Fluoro-2-pyridinyl)piperazine
CID 134987
1-(3,5-Dichloropyridin-2-yl)piperazine
CID 2771431

Frequently Asked Questions

What is the IUPAC name of 1-(3-chloro-2-pyridinyl)-4-methylpiperazine?
The IUPAC name of 1-(3-chloro-2-pyridinyl)-4-methylpiperazine (CID 11959098) is 1-(3-chloro-2-pyridinyl)-4-methylpiperazine.
What is the SMILES notation for 1-(3-chloro-2-pyridinyl)-4-methylpiperazine?
The canonical SMILES for 1-(3-chloro-2-pyridinyl)-4-methylpiperazine is CN1CCN(c2ncccc2Cl)CC1.
What is the InChIKey of 1-(3-chloro-2-pyridinyl)-4-methylpiperazine?
The InChIKey is FNMDXKBBBVNQQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14ClN3/c1-13-5-7-14(8-6-13)10-9(11)3-2-4-12-10/h2-4H,5-8H2,1H3.
What are the key properties of 1-(3-chloro-2-pyridinyl)-4-methylpiperazine?
1-(3-chloro-2-pyridinyl)-4-methylpiperazine has a molecular weight of 211.70 g/mol, XLogP of 1.49, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chloro-2-pyridinyl)-4-methylpiperazine is sourced from PubChem (CID 11959098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).