[1-[(4-methyl-2,3-dihydroquinoxalin-1-yl)methyl]cyclohexyl]methanol

C17H26N2O — CID 63776974

IUPAC[1-[(4-methyl-2,3-dihydroquinoxalin-1-yl)methyl]cyclohexyl]methanol
SMILESCN1CCN(CC2(CO)CCCCC2)c2ccccc21
InChIInChI=1S/C17H26N2O/c1-18-11-12-19(16-8-4-3-7-15(16)18)13-17(14-20)9-5-2-6-10-17/h3-4,7-8,20H,2,5-6,9-14H2,1H3
InChIKeyOJXJMEZPPCNILG-UHFFFAOYSA-N
MW274.41 g/mol
LogP2.89
Rot. Bonds3

About [1-[(4-methyl-2,3-dihydroquinoxalin-1-yl)methyl]cyclohexyl]methanol

[1-[(4-methyl-2,3-dihydroquinoxalin-1-yl)methyl]cyclohexyl]methanol (PubChem CID 63776974) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is [1-[(4-methyl-2,3-dihydroquinoxalin-1-yl)methyl]cyclohexyl]methanol.

Molecular Properties

Compound Name[1-[(4-methyl-2,3-dihydroquinoxalin-1-yl)methyl]cyclohexyl]methanol
PubChem CID63776974
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC Name[1-[(4-methyl-2,3-dihydroquinoxalin-1-yl)methyl]cyclohexyl]methanol
SMILESCN1CCN(CC2(CO)CCCCC2)c2ccccc21
InChIInChI=1S/C17H26N2O/c1-18-11-12-19(16-8-4-3-7-15(16)18)13-17(14-20)9-5-2-6-10-17/h3-4,7-8,20H,2,5-6,9-14H2,1H3
InChIKeyOJXJMEZPPCNILG-UHFFFAOYSA-N
XLogP2.89
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1-[(4-methyl-2,3-dihydroquinoxalin-1-yl)methyl]cyclohexyl]methanol?
The IUPAC name of [1-[(4-methyl-2,3-dihydroquinoxalin-1-yl)methyl]cyclohexyl]methanol (CID 63776974) is [1-[(4-methyl-2,3-dihydroquinoxalin-1-yl)methyl]cyclohexyl]methanol.
What is the SMILES notation for [1-[(4-methyl-2,3-dihydroquinoxalin-1-yl)methyl]cyclohexyl]methanol?
The canonical SMILES for [1-[(4-methyl-2,3-dihydroquinoxalin-1-yl)methyl]cyclohexyl]methanol is CN1CCN(CC2(CO)CCCCC2)c2ccccc21.
What is the InChIKey of [1-[(4-methyl-2,3-dihydroquinoxalin-1-yl)methyl]cyclohexyl]methanol?
The InChIKey is OJXJMEZPPCNILG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-18-11-12-19(16-8-4-3-7-15(16)18)13-17(14-20)9-5-2-6-10-17/h3-4,7-8,20H,2,5-6,9-14H2,1H3.
What are the key properties of [1-[(4-methyl-2,3-dihydroquinoxalin-1-yl)methyl]cyclohexyl]methanol?
[1-[(4-methyl-2,3-dihydroquinoxalin-1-yl)methyl]cyclohexyl]methanol has a molecular weight of 274.41 g/mol, XLogP of 2.89, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(4-methyl-2,3-dihydroquinoxalin-1-yl)methyl]cyclohexyl]methanol is sourced from PubChem (CID 63776974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).