(1,4-dimethylpiperazin-2-yl)-quinolin-6-ylmethanamine

C16H22N4 — CID 81231152

IUPAC(1,4-dimethylpiperazin-2-yl)-quinolin-6-ylmethanamine
SMILESCN1CCN(C)C(C(N)c2ccc3ncccc3c2)C1
InChIInChI=1S/C16H22N4/c1-19-8-9-20(2)15(11-19)16(17)13-5-6-14-12(10-13)4-3-7-18-14/h3-7,10,15-16H,8-9,11,17H2,1-2H3
InChIKeyWYEISTFPPBUIKP-UHFFFAOYSA-N
MW270.38 g/mol
LogP1.48
Rot. Bonds2

About (1,4-dimethylpiperazin-2-yl)-quinolin-6-ylmethanamine

(1,4-dimethylpiperazin-2-yl)-quinolin-6-ylmethanamine (PubChem CID 81231152) has the molecular formula C16H22N4 and a molecular weight of 270.38 g/mol. Its IUPAC name is (1,4-dimethylpiperazin-2-yl)-quinolin-6-ylmethanamine.

Molecular Properties

Compound Name(1,4-dimethylpiperazin-2-yl)-quinolin-6-ylmethanamine
PubChem CID81231152
Molecular FormulaC16H22N4
Molecular Weight270.38 g/mol
Exact Mass270.18
IUPAC Name(1,4-dimethylpiperazin-2-yl)-quinolin-6-ylmethanamine
SMILESCN1CCN(C)C(C(N)c2ccc3ncccc3c2)C1
InChIInChI=1S/C16H22N4/c1-19-8-9-20(2)15(11-19)16(17)13-5-6-14-12(10-13)4-3-7-18-14/h3-7,10,15-16H,8-9,11,17H2,1-2H3
InChIKeyWYEISTFPPBUIKP-UHFFFAOYSA-N
XLogP1.48
TPSA45.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(1,4-dimethylpiperazin-2-yl)-N-methyl-1-quinolin-6-ylmethanamine
CID 81229525
cyclopropyl(quinolin-6-yl)methanamine
CID 55273103
1-quinolin-6-ylbutan-1-amine
CID 63095616
2-(4-methyl-1,4-diazepan-1-yl)-2-quinolin-6-ylethanamine
CID 63968294
7-bicyclo[4.2.0]octa-1,3,5-trienyl(quinolin-6-yl)methanamine
CID 81228640
4-methoxy-1-quinolin-6-ylbutan-1-amine
CID 78924718
2-(4-methylpiperazin-1-yl)-2-quinolin-6-ylacetonitrile
CID 65420095
5-methyl-1-quinolin-6-ylhexan-1-amine
CID 83161358
1-quinolin-6-yldecan-1-amine
CID 63418413
6-(3-quinolin-6-ylbutan-2-yl)quinoline
CID 20658775
2-amino-2-quinolin-6-ylacetonitrile
CID 63968103
N-[(4-methylmorpholin-2-yl)-quinolin-6-ylmethyl]ethanamine
CID 81229498

Frequently Asked Questions

What is the IUPAC name of (1,4-dimethylpiperazin-2-yl)-quinolin-6-ylmethanamine?
The IUPAC name of (1,4-dimethylpiperazin-2-yl)-quinolin-6-ylmethanamine (CID 81231152) is (1,4-dimethylpiperazin-2-yl)-quinolin-6-ylmethanamine.
What is the SMILES notation for (1,4-dimethylpiperazin-2-yl)-quinolin-6-ylmethanamine?
The canonical SMILES for (1,4-dimethylpiperazin-2-yl)-quinolin-6-ylmethanamine is CN1CCN(C)C(C(N)c2ccc3ncccc3c2)C1.
What is the InChIKey of (1,4-dimethylpiperazin-2-yl)-quinolin-6-ylmethanamine?
The InChIKey is WYEISTFPPBUIKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4/c1-19-8-9-20(2)15(11-19)16(17)13-5-6-14-12(10-13)4-3-7-18-14/h3-7,10,15-16H,8-9,11,17H2,1-2H3.
What are the key properties of (1,4-dimethylpiperazin-2-yl)-quinolin-6-ylmethanamine?
(1,4-dimethylpiperazin-2-yl)-quinolin-6-ylmethanamine has a molecular weight of 270.38 g/mol, XLogP of 1.48, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1,4-dimethylpiperazin-2-yl)-quinolin-6-ylmethanamine is sourced from PubChem (CID 81231152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).