6-(3,4-dimethylpiperazin-1-yl)quinolin-5-amine

C15H20N4 — CID 63608727

IUPAC6-(3,4-dimethylpiperazin-1-yl)quinolin-5-amine
SMILESCC1CN(c2ccc3ncccc3c2N)CCN1C
InChIInChI=1S/C15H20N4/c1-11-10-19(9-8-18(11)2)14-6-5-13-12(15(14)16)4-3-7-17-13/h3-7,11H,8-10,16H2,1-2H3
InChIKeySCGPHPIOOKUPEK-UHFFFAOYSA-N
MW256.35 g/mol
LogP1.96
Rot. Bonds1

About 6-(3,4-dimethylpiperazin-1-yl)quinolin-5-amine

6-(3,4-dimethylpiperazin-1-yl)quinolin-5-amine (PubChem CID 63608727) has the molecular formula C15H20N4 and a molecular weight of 256.35 g/mol. Its IUPAC name is 6-(3,4-dimethylpiperazin-1-yl)quinolin-5-amine.

Molecular Properties

Compound Name6-(3,4-dimethylpiperazin-1-yl)quinolin-5-amine
PubChem CID63608727
Molecular FormulaC15H20N4
Molecular Weight256.35 g/mol
Exact Mass256.17
IUPAC Name6-(3,4-dimethylpiperazin-1-yl)quinolin-5-amine
SMILESCC1CN(c2ccc3ncccc3c2N)CCN1C
InChIInChI=1S/C15H20N4/c1-11-10-19(9-8-18(11)2)14-6-5-13-12(15(14)16)4-3-7-17-13/h3-7,11H,8-10,16H2,1-2H3
InChIKeySCGPHPIOOKUPEK-UHFFFAOYSA-N
XLogP1.96
TPSA45.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-(3,4-dimethylpiperazin-1-yl)quinolin-5-amine?
The IUPAC name of 6-(3,4-dimethylpiperazin-1-yl)quinolin-5-amine (CID 63608727) is 6-(3,4-dimethylpiperazin-1-yl)quinolin-5-amine.
What is the SMILES notation for 6-(3,4-dimethylpiperazin-1-yl)quinolin-5-amine?
The canonical SMILES for 6-(3,4-dimethylpiperazin-1-yl)quinolin-5-amine is CC1CN(c2ccc3ncccc3c2N)CCN1C.
What is the InChIKey of 6-(3,4-dimethylpiperazin-1-yl)quinolin-5-amine?
The InChIKey is SCGPHPIOOKUPEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4/c1-11-10-19(9-8-18(11)2)14-6-5-13-12(15(14)16)4-3-7-17-13/h3-7,11H,8-10,16H2,1-2H3.
What are the key properties of 6-(3,4-dimethylpiperazin-1-yl)quinolin-5-amine?
6-(3,4-dimethylpiperazin-1-yl)quinolin-5-amine has a molecular weight of 256.35 g/mol, XLogP of 1.96, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3,4-dimethylpiperazin-1-yl)quinolin-5-amine is sourced from PubChem (CID 63608727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).