[2-[(3-aminoquinoxalin-2-yl)amino]cyclohexyl]methanol

C15H20N4O — CID 106367963

IUPAC[2-[(3-aminoquinoxalin-2-yl)amino]cyclohexyl]methanol
SMILESNc1nc2ccccc2nc1NC1CCCCC1CO
InChIInChI=1S/C15H20N4O/c16-14-15(18-11-6-2-1-5-10(11)9-20)19-13-8-4-3-7-12(13)17-14/h3-4,7-8,10-11,20H,1-2,5-6,9H2,(H2,16,17)(H,18,19)
InChIKeyGLHRYQJUEROTMN-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.17
Rot. Bonds3

About [2-[(3-aminoquinoxalin-2-yl)amino]cyclohexyl]methanol

[2-[(3-aminoquinoxalin-2-yl)amino]cyclohexyl]methanol (PubChem CID 106367963) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is [2-[(3-aminoquinoxalin-2-yl)amino]cyclohexyl]methanol.

Molecular Properties

Compound Name[2-[(3-aminoquinoxalin-2-yl)amino]cyclohexyl]methanol
PubChem CID106367963
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name[2-[(3-aminoquinoxalin-2-yl)amino]cyclohexyl]methanol
SMILESNc1nc2ccccc2nc1NC1CCCCC1CO
InChIInChI=1S/C15H20N4O/c16-14-15(18-11-6-2-1-5-10(11)9-20)19-13-8-4-3-7-12(13)17-14/h3-4,7-8,10-11,20H,1-2,5-6,9H2,(H2,16,17)(H,18,19)
InChIKeyGLHRYQJUEROTMN-UHFFFAOYSA-N
XLogP2.17
TPSA84.06 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.17
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [2-[(3-aminoquinoxalin-2-yl)amino]cyclohexyl]methanol?
The IUPAC name of [2-[(3-aminoquinoxalin-2-yl)amino]cyclohexyl]methanol (CID 106367963) is [2-[(3-aminoquinoxalin-2-yl)amino]cyclohexyl]methanol.
What is the SMILES notation for [2-[(3-aminoquinoxalin-2-yl)amino]cyclohexyl]methanol?
The canonical SMILES for [2-[(3-aminoquinoxalin-2-yl)amino]cyclohexyl]methanol is Nc1nc2ccccc2nc1NC1CCCCC1CO.
What is the InChIKey of [2-[(3-aminoquinoxalin-2-yl)amino]cyclohexyl]methanol?
The InChIKey is GLHRYQJUEROTMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c16-14-15(18-11-6-2-1-5-10(11)9-20)19-13-8-4-3-7-12(13)17-14/h3-4,7-8,10-11,20H,1-2,5-6,9H2,(H2,16,17)(H,18,19).
What are the key properties of [2-[(3-aminoquinoxalin-2-yl)amino]cyclohexyl]methanol?
[2-[(3-aminoquinoxalin-2-yl)amino]cyclohexyl]methanol has a molecular weight of 272.35 g/mol, XLogP of 2.17, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(3-aminoquinoxalin-2-yl)amino]cyclohexyl]methanol is sourced from PubChem (CID 106367963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).