2-N,3-N-dimethyl-3-N-piperidin-4-ylquinoxaline-2,3-diamine

C15H21N5 — CID 71642511

IUPAC2-N,3-N-dimethyl-3-N-piperidin-4-ylquinoxaline-2,3-diamine
SMILESCNc1nc2ccccc2nc1N(C)C1CCNCC1
InChIInChI=1S/C15H21N5/c1-16-14-15(20(2)11-7-9-17-10-8-11)19-13-6-4-3-5-12(13)18-14/h3-6,11,17H,7-10H2,1-2H3,(H,16,18)
InChIKeyRLFJASRIJZRRAT-UHFFFAOYSA-N
MW271.37 g/mol
LogP1.86
Rot. Bonds3

About 2-N,3-N-dimethyl-3-N-piperidin-4-ylquinoxaline-2,3-diamine

2-N,3-N-dimethyl-3-N-piperidin-4-ylquinoxaline-2,3-diamine (PubChem CID 71642511) has the molecular formula C15H21N5 and a molecular weight of 271.37 g/mol. Its IUPAC name is 2-N,3-N-dimethyl-3-N-piperidin-4-ylquinoxaline-2,3-diamine.

Molecular Properties

Compound Name2-N,3-N-dimethyl-3-N-piperidin-4-ylquinoxaline-2,3-diamine
PubChem CID71642511
Molecular FormulaC15H21N5
Molecular Weight271.37 g/mol
Exact Mass271.18
IUPAC Name2-N,3-N-dimethyl-3-N-piperidin-4-ylquinoxaline-2,3-diamine
SMILESCNc1nc2ccccc2nc1N(C)C1CCNCC1
InChIInChI=1S/C15H21N5/c1-16-14-15(20(2)11-7-9-17-10-8-11)19-13-6-4-3-5-12(13)18-14/h3-6,11,17H,7-10H2,1-2H3,(H,16,18)
InChIKeyRLFJASRIJZRRAT-UHFFFAOYSA-N
XLogP1.86
TPSA53.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.37
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-N,3-N-dimethyl-3-N-[(3S)-pyrrolidin-3-yl]quinoxaline-2,3-diamine
CID 71642505
2-N,3-N-dimethyl-3-N-[(3R)-pyrrolidin-3-yl]quinoxaline-2,3-diamine;hydrochloride
CID 71642500
2-N,3-N-dimethyl-3-N-[(3S)-piperidin-3-yl]quinoxaline-2,3-diamine
CID 71642503
N,3-dimethyl-N-pyrrolidin-3-ylquinoxalin-2-amine
CID 55205906
tert-butyl 4-[methyl-[3-(methylamino)quinoxalin-2-yl]amino]piperidine-1-carboxylate
CID 71648017
1-N,4-N-dimethyl-4-N-(3-methylquinoxalin-2-yl)cyclohexane-1,4-diamine
CID 79117532
3-ethoxy-N-methyl-N-[(3R)-pyrrolidin-3-yl]quinoxalin-2-amine
CID 71639631
3-ethoxy-N-methyl-N-[(3S)-pyrrolidin-3-yl]quinoxalin-2-amine
CID 71639635
3-N-cyclobutyl-3-N-methylquinoxaline-2,3-diamine
CID 102987398
3-N-cycloheptyl-3-N-methylquinoxaline-2,3-diamine
CID 102985570
2-N-methyl-3-N-[(3R)-piperidin-3-yl]quinoxaline-2,3-diamine
CID 71642523
N-cyclopropyl-N-methyl-3-[(E)-prop-1-enyl]quinoxalin-2-amine
CID 58327983

Frequently Asked Questions

What is the IUPAC name of 2-N,3-N-dimethyl-3-N-piperidin-4-ylquinoxaline-2,3-diamine?
The IUPAC name of 2-N,3-N-dimethyl-3-N-piperidin-4-ylquinoxaline-2,3-diamine (CID 71642511) is 2-N,3-N-dimethyl-3-N-piperidin-4-ylquinoxaline-2,3-diamine.
What is the SMILES notation for 2-N,3-N-dimethyl-3-N-piperidin-4-ylquinoxaline-2,3-diamine?
The canonical SMILES for 2-N,3-N-dimethyl-3-N-piperidin-4-ylquinoxaline-2,3-diamine is CNc1nc2ccccc2nc1N(C)C1CCNCC1.
What is the InChIKey of 2-N,3-N-dimethyl-3-N-piperidin-4-ylquinoxaline-2,3-diamine?
The InChIKey is RLFJASRIJZRRAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5/c1-16-14-15(20(2)11-7-9-17-10-8-11)19-13-6-4-3-5-12(13)18-14/h3-6,11,17H,7-10H2,1-2H3,(H,16,18).
What are the key properties of 2-N,3-N-dimethyl-3-N-piperidin-4-ylquinoxaline-2,3-diamine?
2-N,3-N-dimethyl-3-N-piperidin-4-ylquinoxaline-2,3-diamine has a molecular weight of 271.37 g/mol, XLogP of 1.86, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,3-N-dimethyl-3-N-piperidin-4-ylquinoxaline-2,3-diamine is sourced from PubChem (CID 71642511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).