N-[(1,4-dimethylpiperazin-2-yl)methyl]quinolin-2-amine

C16H22N4 — CID 63896921

IUPACN-[(1,4-dimethylpiperazin-2-yl)methyl]quinolin-2-amine
SMILESCN1CCN(C)C(CNc2ccc3ccccc3n2)C1
InChIInChI=1S/C16H22N4/c1-19-9-10-20(2)14(12-19)11-17-16-8-7-13-5-3-4-6-15(13)18-16/h3-8,14H,9-12H2,1-2H3,(H,17,18)
InChIKeyBXIFNQLSBUPWCZ-UHFFFAOYSA-N
MW270.38 g/mol
LogP1.89
Rot. Bonds3

About N-[(1,4-dimethylpiperazin-2-yl)methyl]quinolin-2-amine

N-[(1,4-dimethylpiperazin-2-yl)methyl]quinolin-2-amine (PubChem CID 63896921) has the molecular formula C16H22N4 and a molecular weight of 270.38 g/mol. Its IUPAC name is N-[(1,4-dimethylpiperazin-2-yl)methyl]quinolin-2-amine.

Molecular Properties

Compound NameN-[(1,4-dimethylpiperazin-2-yl)methyl]quinolin-2-amine
PubChem CID63896921
Molecular FormulaC16H22N4
Molecular Weight270.38 g/mol
Exact Mass270.18
IUPAC NameN-[(1,4-dimethylpiperazin-2-yl)methyl]quinolin-2-amine
SMILESCN1CCN(C)C(CNc2ccc3ccccc3n2)C1
InChIInChI=1S/C16H22N4/c1-19-9-10-20(2)14(12-19)11-17-16-8-7-13-5-3-4-6-15(13)18-16/h3-8,14H,9-12H2,1-2H3,(H,17,18)
InChIKeyBXIFNQLSBUPWCZ-UHFFFAOYSA-N
XLogP1.89
TPSA31.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1,4-dimethylpiperazin-2-yl)methyl]quinoxalin-2-amine
CID 63898211
6-N-[(1,4-dimethylpiperazin-2-yl)methyl]pyridine-2,6-diamine
CID 80647172
N-[(1,4-dimethylpiperazin-2-yl)methyl]pyrido[2,3-b]pyrazin-6-amine
CID 78954799
N-[(1,4-dimethylpiperazin-2-yl)methyl]naphthalen-2-amine
CID 63897643
N-[[(3S)-1-phenylpyrrolidin-3-yl]methyl]quinolin-2-amine
CID 97312348
6-[(1,4-dimethylpiperazin-2-yl)methylamino]pyridine-3-carbonitrile
CID 63896552
6-[(1,4-dimethylpiperazin-2-yl)methylamino]-N,N-dimethylpyridine-2-carboxamide;formic acid
CID 154914525
4-N-[(1,4-dimethylpiperazin-2-yl)methyl]-6-methylpyrimidine-2,4-diamine
CID 78954732
N-[(1,4-dimethylpiperazin-2-yl)methyl]-4,6-dimethylpyrimidin-2-amine
CID 63899169
1-(1,3-benzothiazol-2-yl)-N-[(1,4-dimethylpiperazin-2-yl)methyl]ethanamine
CID 63897986
tert-butyl 2-[(quinolin-2-ylamino)methyl]piperidine-1-carboxylate
CID 86593668
2-[(1,4-dimethylpiperazin-2-yl)methylamino]pyridine-3-carboxamide
CID 63898975

Frequently Asked Questions

What is the IUPAC name of N-[(1,4-dimethylpiperazin-2-yl)methyl]quinolin-2-amine?
The IUPAC name of N-[(1,4-dimethylpiperazin-2-yl)methyl]quinolin-2-amine (CID 63896921) is N-[(1,4-dimethylpiperazin-2-yl)methyl]quinolin-2-amine.
What is the SMILES notation for N-[(1,4-dimethylpiperazin-2-yl)methyl]quinolin-2-amine?
The canonical SMILES for N-[(1,4-dimethylpiperazin-2-yl)methyl]quinolin-2-amine is CN1CCN(C)C(CNc2ccc3ccccc3n2)C1.
What is the InChIKey of N-[(1,4-dimethylpiperazin-2-yl)methyl]quinolin-2-amine?
The InChIKey is BXIFNQLSBUPWCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4/c1-19-9-10-20(2)14(12-19)11-17-16-8-7-13-5-3-4-6-15(13)18-16/h3-8,14H,9-12H2,1-2H3,(H,17,18).
What are the key properties of N-[(1,4-dimethylpiperazin-2-yl)methyl]quinolin-2-amine?
N-[(1,4-dimethylpiperazin-2-yl)methyl]quinolin-2-amine has a molecular weight of 270.38 g/mol, XLogP of 1.89, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1,4-dimethylpiperazin-2-yl)methyl]quinolin-2-amine is sourced from PubChem (CID 63896921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).