3-N-(2-aminocyclohexyl)quinoxaline-2,3-diamine;hydrochloride

C14H20ClN5 — CID 71644139

IUPAC3-N-(2-aminocyclohexyl)quinoxaline-2,3-diamine;hydrochloride
SMILESCl.Nc1nc2ccccc2nc1NC1CCCCC1N
InChIInChI=1S/C14H19N5.ClH/c15-9-5-1-2-6-10(9)18-14-13(16)17-11-7-3-4-8-12(11)19-14;/h3-4,7-10H,1-2,5-6,15H2,(H2,16,17)(H,18,19);1H
InChIKeyODCBDBBHSSHMNQ-UHFFFAOYSA-N
MW293.80 g/mol
LogP2.32
Rot. Bonds2

About 3-N-(2-aminocyclohexyl)quinoxaline-2,3-diamine;hydrochloride

3-N-(2-aminocyclohexyl)quinoxaline-2,3-diamine;hydrochloride (PubChem CID 71644139) has the molecular formula C14H20ClN5 and a molecular weight of 293.80 g/mol. Its IUPAC name is 3-N-(2-aminocyclohexyl)quinoxaline-2,3-diamine;hydrochloride.

Molecular Properties

Compound Name3-N-(2-aminocyclohexyl)quinoxaline-2,3-diamine;hydrochloride
PubChem CID71644139
Molecular FormulaC14H20ClN5
Molecular Weight293.80 g/mol
Exact Mass293.14
IUPAC Name3-N-(2-aminocyclohexyl)quinoxaline-2,3-diamine;hydrochloride
SMILESCl.Nc1nc2ccccc2nc1NC1CCCCC1N
InChIInChI=1S/C14H19N5.ClH/c15-9-5-1-2-6-10(9)18-14-13(16)17-11-7-3-4-8-12(11)19-14;/h3-4,7-10H,1-2,5-6,15H2,(H2,16,17)(H,18,19);1H
InChIKeyODCBDBBHSSHMNQ-UHFFFAOYSA-N
XLogP2.32
TPSA89.85 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.80
LogP ≤ 52.32
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

trans-(1R,2R)-2-N-(3-chloroquinoxalin-2-yl)cyclohexane-1,2-diamine
CID 97165233
2-N-(3-chloroquinoxalin-2-yl)cyclohexane-1,2-diamine
CID 71644138
3-N-[(1S,2S)-2-aminocyclohexyl]-2-N-methylquinoxaline-2,3-diamine
CID 97164701
[2-[(3-aminoquinoxalin-2-yl)amino]cyclohexyl]methanol
CID 106367963
1-N-(3-methylquinoxalin-2-yl)cycloheptane-1,2-diamine
CID 63258631
2-N-(3-methoxyquinoxalin-2-yl)cyclohexane-1,2-diamine
CID 71643079
cis-(1R,2S)-2-N-(3-methoxyquinoxalin-2-yl)cyclohexane-1,2-diamine
CID 97164902
2-N-(3-methylquinolin-2-yl)cyclohexane-1,2-diamine
CID 63229478
cis-(1R,2S)-2-N-(3-ethoxyquinoxalin-2-yl)cyclohexane-1,2-diamine
CID 97163468
3-N-(2-methylcyclopropyl)quinoxaline-2,3-diamine
CID 102984290
3-N-(2,3-dimethylcyclopentyl)quinoxaline-2,3-diamine
CID 102984543
2-[[(1R,2R)-2-aminocyclohexyl]amino]quinoline-3-carboxamide
CID 102738838

Frequently Asked Questions

What is the IUPAC name of 3-N-(2-aminocyclohexyl)quinoxaline-2,3-diamine;hydrochloride?
The IUPAC name of 3-N-(2-aminocyclohexyl)quinoxaline-2,3-diamine;hydrochloride (CID 71644139) is 3-N-(2-aminocyclohexyl)quinoxaline-2,3-diamine;hydrochloride.
What is the SMILES notation for 3-N-(2-aminocyclohexyl)quinoxaline-2,3-diamine;hydrochloride?
The canonical SMILES for 3-N-(2-aminocyclohexyl)quinoxaline-2,3-diamine;hydrochloride is Cl.Nc1nc2ccccc2nc1NC1CCCCC1N.
What is the InChIKey of 3-N-(2-aminocyclohexyl)quinoxaline-2,3-diamine;hydrochloride?
The InChIKey is ODCBDBBHSSHMNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5.ClH/c15-9-5-1-2-6-10(9)18-14-13(16)17-11-7-3-4-8-12(11)19-14;/h3-4,7-10H,1-2,5-6,15H2,(H2,16,17)(H,18,19);1H.
What are the key properties of 3-N-(2-aminocyclohexyl)quinoxaline-2,3-diamine;hydrochloride?
3-N-(2-aminocyclohexyl)quinoxaline-2,3-diamine;hydrochloride has a molecular weight of 293.80 g/mol, XLogP of 2.32, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-(2-aminocyclohexyl)quinoxaline-2,3-diamine;hydrochloride is sourced from PubChem (CID 71644139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).