7-methoxy-4-methyl-2-piperazin-1-ylquinoline;hydrochloride

C15H20ClN3O — CID 121237212

IUPAC7-methoxy-4-methyl-2-piperazin-1-ylquinoline;hydrochloride
SMILESCOc1ccc2c(C)cc(N3CCNCC3)nc2c1.Cl
InChIInChI=1S/C15H19N3O.ClH/c1-11-9-15(18-7-5-16-6-8-18)17-14-10-12(19-2)3-4-13(11)14;/h3-4,9-10,16H,5-8H2,1-2H3;1H
InChIKeyOTHGZEVBAIOPJJ-UHFFFAOYSA-N
MW293.80 g/mol
LogP2.38
Rot. Bonds2

About 7-methoxy-4-methyl-2-piperazin-1-ylquinoline;hydrochloride

7-methoxy-4-methyl-2-piperazin-1-ylquinoline;hydrochloride (PubChem CID 121237212) has the molecular formula C15H20ClN3O and a molecular weight of 293.80 g/mol. Its IUPAC name is 7-methoxy-4-methyl-2-piperazin-1-ylquinoline;hydrochloride.

Molecular Properties

Compound Name7-methoxy-4-methyl-2-piperazin-1-ylquinoline;hydrochloride
PubChem CID121237212
Molecular FormulaC15H20ClN3O
Molecular Weight293.80 g/mol
Exact Mass293.13
IUPAC Name7-methoxy-4-methyl-2-piperazin-1-ylquinoline;hydrochloride
SMILESCOc1ccc2c(C)cc(N3CCNCC3)nc2c1.Cl
InChIInChI=1S/C15H19N3O.ClH/c1-11-9-15(18-7-5-16-6-8-18)17-14-10-12(19-2)3-4-13(11)14;/h3-4,9-10,16H,5-8H2,1-2H3;1H
InChIKeyOTHGZEVBAIOPJJ-UHFFFAOYSA-N
XLogP2.38
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.80
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-methyl-2-piperazin-1-ylquinolin-7-ol
CID 136918047
4-methyl-2-piperazin-1-ylquinoline
CID 598754
7-methoxy-3-methyl-2-piperazin-1-ylquinoline;hydrochloride
CID 121237209
1-(7-methoxy-4-methylquinolin-2-yl)-N,N-dimethylpiperidine-4-carboxamide
CID 171691583
7-chloro-4,6-dimethyl-2-piperazin-1-ylquinoline
CID 69237633
2-[4-(4-methoxyphenyl)piperazin-1-yl]-4-methylquinoline
CID 4884632
(3S,4R)-4-cyclopropyl-1-(7-methoxy-4-methylquinolin-2-yl)pyrrolidin-3-amine
CID 133130921
2-(3,5-dimethylpyrazol-1-yl)-7-methoxy-4-methylquinoline
CID 3683269
1-(7-methoxy-4-methylquinolin-2-yl)piperidine-3-carboxamide
CID 172900595
7-methoxy-4-piperazin-1-yl-2-propylquinoline
CID 121237211
7-methoxy-2-phenyl-4-piperazin-1-ylquinoline
CID 121237208
[1-(7-methoxy-4-methylquinolin-2-yl)azetidin-3-yl]-morpholin-4-ylmethanone
CID 163354868

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-4-methyl-2-piperazin-1-ylquinoline;hydrochloride?
The IUPAC name of 7-methoxy-4-methyl-2-piperazin-1-ylquinoline;hydrochloride (CID 121237212) is 7-methoxy-4-methyl-2-piperazin-1-ylquinoline;hydrochloride.
What is the SMILES notation for 7-methoxy-4-methyl-2-piperazin-1-ylquinoline;hydrochloride?
The canonical SMILES for 7-methoxy-4-methyl-2-piperazin-1-ylquinoline;hydrochloride is COc1ccc2c(C)cc(N3CCNCC3)nc2c1.Cl.
What is the InChIKey of 7-methoxy-4-methyl-2-piperazin-1-ylquinoline;hydrochloride?
The InChIKey is OTHGZEVBAIOPJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O.ClH/c1-11-9-15(18-7-5-16-6-8-18)17-14-10-12(19-2)3-4-13(11)14;/h3-4,9-10,16H,5-8H2,1-2H3;1H.
What are the key properties of 7-methoxy-4-methyl-2-piperazin-1-ylquinoline;hydrochloride?
7-methoxy-4-methyl-2-piperazin-1-ylquinoline;hydrochloride has a molecular weight of 293.80 g/mol, XLogP of 2.38, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-4-methyl-2-piperazin-1-ylquinoline;hydrochloride is sourced from PubChem (CID 121237212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).