2-N,3-N-dimethyl-3-N-[(3R)-pyrrolidin-3-yl]quinoxaline-2,3-diamine;hydrochloride

C14H20ClN5 — CID 71642500

IUPAC2-N,3-N-dimethyl-3-N-[(3R)-pyrrolidin-3-yl]quinoxaline-2,3-diamine;hydrochloride
SMILESCNc1nc2ccccc2nc1N(C)[C@@H]1CCNC1.Cl
InChIInChI=1S/C14H19N5.ClH/c1-15-13-14(19(2)10-7-8-16-9-10)18-12-6-4-3-5-11(12)17-13;/h3-6,10,16H,7-9H2,1-2H3,(H,15,17);1H/t10-;/m1./s1
InChIKeyCJSXJNPTUVDWQM-HNCPQSOCSA-N
MW293.80 g/mol
LogP1.89
Rot. Bonds3

About 2-N,3-N-dimethyl-3-N-[(3R)-pyrrolidin-3-yl]quinoxaline-2,3-diamine;hydrochloride

2-N,3-N-dimethyl-3-N-[(3R)-pyrrolidin-3-yl]quinoxaline-2,3-diamine;hydrochloride (PubChem CID 71642500) has the molecular formula C14H20ClN5 and a molecular weight of 293.80 g/mol. Its IUPAC name is 2-N,3-N-dimethyl-3-N-[(3R)-pyrrolidin-3-yl]quinoxaline-2,3-diamine;hydrochloride.

Molecular Properties

Compound Name2-N,3-N-dimethyl-3-N-[(3R)-pyrrolidin-3-yl]quinoxaline-2,3-diamine;hydrochloride
PubChem CID71642500
Molecular FormulaC14H20ClN5
Molecular Weight293.80 g/mol
Exact Mass293.14
IUPAC Name2-N,3-N-dimethyl-3-N-[(3R)-pyrrolidin-3-yl]quinoxaline-2,3-diamine;hydrochloride
SMILESCNc1nc2ccccc2nc1N(C)[C@@H]1CCNC1.Cl
InChIInChI=1S/C14H19N5.ClH/c1-15-13-14(19(2)10-7-8-16-9-10)18-12-6-4-3-5-11(12)17-13;/h3-6,10,16H,7-9H2,1-2H3,(H,15,17);1H/t10-;/m1./s1
InChIKeyCJSXJNPTUVDWQM-HNCPQSOCSA-N
XLogP1.89
TPSA53.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.80
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-N,3-N-dimethyl-3-N-[(3R)-pyrrolidin-3-yl]quinoxaline-2,3-diamine;hydrochloride with MolForge

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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-[(3S)-piperidin-3-yl]quinoxaline-2,3-diamine
CID 71642503
2-N,3-N-dimethyl-3-N-piperidin-4-ylquinoxaline-2,3-diamine
CID 71642511
N,3-dimethyl-N-pyrrolidin-3-ylquinoxalin-2-amine
CID 55205906
3-ethoxy-N-methyl-N-[(3S)-pyrrolidin-3-yl]quinoxalin-2-amine
CID 71639635
3-ethoxy-N-methyl-N-[(3R)-pyrrolidin-3-yl]quinoxalin-2-amine
CID 71639631
N-methyl-N-[(3R)-pyrrolidin-3-yl]quinoxalin-2-amine;hydrochloride
CID 71641013
3-methoxy-N-methyl-N-[(3R)-piperidin-3-yl]quinoxalin-2-amine;hydrochloride
CID 71643020
3-methoxy-N-methyl-N-[(3S)-piperidin-3-yl]quinoxalin-2-amine
CID 71643025
N-methyl-N-pyrrolidin-3-yl-1,2-benzothiazol-3-amine;hydrochloride
CID 71641425
N-methyl-N-[(3R)-pyrrolidin-3-yl]-1,2-benzothiazol-3-amine;hydrochloride
CID 71641030
3-ethoxy-N-methyl-N-[(3S)-piperidin-3-yl]quinoxalin-2-amine
CID 71639633

Frequently Asked Questions

What is the IUPAC name of 2-N,3-N-dimethyl-3-N-[(3R)-pyrrolidin-3-yl]quinoxaline-2,3-diamine;hydrochloride?
The IUPAC name of 2-N,3-N-dimethyl-3-N-[(3R)-pyrrolidin-3-yl]quinoxaline-2,3-diamine;hydrochloride (CID 71642500) is 2-N,3-N-dimethyl-3-N-[(3R)-pyrrolidin-3-yl]quinoxaline-2,3-diamine;hydrochloride.
What is the SMILES notation for 2-N,3-N-dimethyl-3-N-[(3R)-pyrrolidin-3-yl]quinoxaline-2,3-diamine;hydrochloride?
The canonical SMILES for 2-N,3-N-dimethyl-3-N-[(3R)-pyrrolidin-3-yl]quinoxaline-2,3-diamine;hydrochloride is CNc1nc2ccccc2nc1N(C)[C@@H]1CCNC1.Cl.
What is the InChIKey of 2-N,3-N-dimethyl-3-N-[(3R)-pyrrolidin-3-yl]quinoxaline-2,3-diamine;hydrochloride?
The InChIKey is CJSXJNPTUVDWQM-HNCPQSOCSA-N. The full InChI is InChI=1S/C14H19N5.ClH/c1-15-13-14(19(2)10-7-8-16-9-10)18-12-6-4-3-5-11(12)17-13;/h3-6,10,16H,7-9H2,1-2H3,(H,15,17);1H/t10-;/m1./s1.
What are the key properties of 2-N,3-N-dimethyl-3-N-[(3R)-pyrrolidin-3-yl]quinoxaline-2,3-diamine;hydrochloride?
2-N,3-N-dimethyl-3-N-[(3R)-pyrrolidin-3-yl]quinoxaline-2,3-diamine;hydrochloride has a molecular weight of 293.80 g/mol, XLogP of 1.89, 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-[(3R)-pyrrolidin-3-yl]quinoxaline-2,3-diamine;hydrochloride is sourced from PubChem (CID 71642500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).