2-methyl-4-(4-methylpiperazin-1-yl)quinolin-8-ol;hydrochloride

C15H20ClN3O — CID 19603387

IUPAC2-methyl-4-(4-methylpiperazin-1-yl)quinolin-8-ol;hydrochloride
SMILESCc1cc(N2CCN(C)CC2)c2cccc(O)c2n1.Cl
InChIInChI=1S/C15H19N3O.ClH/c1-11-10-13(18-8-6-17(2)7-9-18)12-4-3-5-14(19)15(12)16-11;/h3-5,10,19H,6-9H2,1-2H3;1H
InChIKeySFLXAJQWTISFEB-UHFFFAOYSA-N
MW293.80 g/mol
LogP2.42
Rot. Bonds1

About 2-methyl-4-(4-methylpiperazin-1-yl)quinolin-8-ol;hydrochloride

2-methyl-4-(4-methylpiperazin-1-yl)quinolin-8-ol;hydrochloride (PubChem CID 19603387) has the molecular formula C15H20ClN3O and a molecular weight of 293.80 g/mol. Its IUPAC name is 2-methyl-4-(4-methylpiperazin-1-yl)quinolin-8-ol;hydrochloride.

Molecular Properties

Compound Name2-methyl-4-(4-methylpiperazin-1-yl)quinolin-8-ol;hydrochloride
PubChem CID19603387
Molecular FormulaC15H20ClN3O
Molecular Weight293.80 g/mol
Exact Mass293.13
IUPAC Name2-methyl-4-(4-methylpiperazin-1-yl)quinolin-8-ol;hydrochloride
SMILESCc1cc(N2CCN(C)CC2)c2cccc(O)c2n1.Cl
InChIInChI=1S/C15H19N3O.ClH/c1-11-10-13(18-8-6-17(2)7-9-18)12-4-3-5-14(19)15(12)16-11;/h3-5,10,19H,6-9H2,1-2H3;1H
InChIKeySFLXAJQWTISFEB-UHFFFAOYSA-N
XLogP2.42
TPSA39.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.80
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-(4-methylpiperazin-1-yl)quinolin-8-ol;hydrochloride?
The IUPAC name of 2-methyl-4-(4-methylpiperazin-1-yl)quinolin-8-ol;hydrochloride (CID 19603387) is 2-methyl-4-(4-methylpiperazin-1-yl)quinolin-8-ol;hydrochloride.
What is the SMILES notation for 2-methyl-4-(4-methylpiperazin-1-yl)quinolin-8-ol;hydrochloride?
The canonical SMILES for 2-methyl-4-(4-methylpiperazin-1-yl)quinolin-8-ol;hydrochloride is Cc1cc(N2CCN(C)CC2)c2cccc(O)c2n1.Cl.
What is the InChIKey of 2-methyl-4-(4-methylpiperazin-1-yl)quinolin-8-ol;hydrochloride?
The InChIKey is SFLXAJQWTISFEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O.ClH/c1-11-10-13(18-8-6-17(2)7-9-18)12-4-3-5-14(19)15(12)16-11;/h3-5,10,19H,6-9H2,1-2H3;1H.
What are the key properties of 2-methyl-4-(4-methylpiperazin-1-yl)quinolin-8-ol;hydrochloride?
2-methyl-4-(4-methylpiperazin-1-yl)quinolin-8-ol;hydrochloride has a molecular weight of 293.80 g/mol, XLogP of 2.42, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-(4-methylpiperazin-1-yl)quinolin-8-ol;hydrochloride is sourced from PubChem (CID 19603387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).