3-(4-propylpiperidin-1-yl)quinoxalin-2-amine

C16H22N4 — CID 102986310

IUPAC3-(4-propylpiperidin-1-yl)quinoxalin-2-amine
SMILESCCCC1CCN(c2nc3ccccc3nc2N)CC1
InChIInChI=1S/C16H22N4/c1-2-5-12-8-10-20(11-9-12)16-15(17)18-13-6-3-4-7-14(13)19-16/h3-4,6-7,12H,2,5,8-11H2,1H3,(H2,17,18)
InChIKeyNKYMTHJLWBKOMX-UHFFFAOYSA-N
MW270.38 g/mol
LogP3.23
Rot. Bonds3

About 3-(4-propylpiperidin-1-yl)quinoxalin-2-amine

3-(4-propylpiperidin-1-yl)quinoxalin-2-amine (PubChem CID 102986310) has the molecular formula C16H22N4 and a molecular weight of 270.38 g/mol. Its IUPAC name is 3-(4-propylpiperidin-1-yl)quinoxalin-2-amine.

Molecular Properties

Compound Name3-(4-propylpiperidin-1-yl)quinoxalin-2-amine
PubChem CID102986310
Molecular FormulaC16H22N4
Molecular Weight270.38 g/mol
Exact Mass270.18
IUPAC Name3-(4-propylpiperidin-1-yl)quinoxalin-2-amine
SMILESCCCC1CCN(c2nc3ccccc3nc2N)CC1
InChIInChI=1S/C16H22N4/c1-2-5-12-8-10-20(11-9-12)16-15(17)18-13-6-3-4-7-14(13)19-16/h3-4,6-7,12H,2,5,8-11H2,1H3,(H2,17,18)
InChIKeyNKYMTHJLWBKOMX-UHFFFAOYSA-N
XLogP3.23
TPSA55.04 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 ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[(3S)-3-aminopyrrolidin-1-yl]quinoxalin-2-amine;hydrochloride
CID 71643981
3-(4-cyclopropylpiperazin-1-yl)quinoxalin-2-amine
CID 102986229
3,5-difluoro-6-(4-propylpiperidin-1-yl)pyridin-2-amine
CID 114074421
3-[(3S)-3-aminopiperidin-1-yl]quinoxalin-2-amine
CID 97165327
3-[(3S)-3-(aminomethyl)piperidin-1-yl]quinoxalin-2-amine
CID 97165472
2-tert-butyl-5-methyl-6-(4-propylpiperidin-1-yl)pyrimidin-4-amine
CID 80984976
3-(3,4-dimethoxypyrrolidin-1-yl)quinoxalin-2-amine
CID 103541708
3-[(2R,6S)-2,6-dimethylmorpholin-4-yl]quinoxalin-2-amine
CID 102987519
[6-(4-propylpiperidin-1-yl)-2-pyridinyl]hydrazine
CID 80908275
3-N-[(1-methylpiperidin-4-yl)methyl]quinoxaline-2,3-diamine
CID 102984126
2-fluoro-6-(4-propylpiperidin-1-yl)pyridine
CID 62205633
2-(4-propylpiperidin-1-yl)-1,3-benzoxazol-5-amine
CID 79890054

Frequently Asked Questions

What is the IUPAC name of 3-(4-propylpiperidin-1-yl)quinoxalin-2-amine?
The IUPAC name of 3-(4-propylpiperidin-1-yl)quinoxalin-2-amine (CID 102986310) is 3-(4-propylpiperidin-1-yl)quinoxalin-2-amine.
What is the SMILES notation for 3-(4-propylpiperidin-1-yl)quinoxalin-2-amine?
The canonical SMILES for 3-(4-propylpiperidin-1-yl)quinoxalin-2-amine is CCCC1CCN(c2nc3ccccc3nc2N)CC1.
What is the InChIKey of 3-(4-propylpiperidin-1-yl)quinoxalin-2-amine?
The InChIKey is NKYMTHJLWBKOMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4/c1-2-5-12-8-10-20(11-9-12)16-15(17)18-13-6-3-4-7-14(13)19-16/h3-4,6-7,12H,2,5,8-11H2,1H3,(H2,17,18).
What are the key properties of 3-(4-propylpiperidin-1-yl)quinoxalin-2-amine?
3-(4-propylpiperidin-1-yl)quinoxalin-2-amine has a molecular weight of 270.38 g/mol, XLogP of 3.23, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-propylpiperidin-1-yl)quinoxalin-2-amine is sourced from PubChem (CID 102986310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).