4-cyclopentyl-2,3-dihydro-1H-quinoxaline

C13H18N2 — CID 71683750

IUPAC4-cyclopentyl-2,3-dihydro-1H-quinoxaline
SMILESc1ccc2c(c1)NCCN2C1CCCC1
InChIInChI=1S/C13H18N2/c1-2-6-11(5-1)15-10-9-14-12-7-3-4-8-13(12)15/h3-4,7-8,11,14H,1-2,5-6,9-10H2
InChIKeyODYHMBBRAZIQQQ-UHFFFAOYSA-N
MW202.30 g/mol
LogP2.86
Rot. Bonds1

About 4-cyclopentyl-2,3-dihydro-1H-quinoxaline

4-cyclopentyl-2,3-dihydro-1H-quinoxaline (PubChem CID 71683750) has the molecular formula C13H18N2 and a molecular weight of 202.30 g/mol. Its IUPAC name is 4-cyclopentyl-2,3-dihydro-1H-quinoxaline.

Molecular Properties

Compound Name4-cyclopentyl-2,3-dihydro-1H-quinoxaline
PubChem CID71683750
Molecular FormulaC13H18N2
Molecular Weight202.30 g/mol
Exact Mass202.15
IUPAC Name4-cyclopentyl-2,3-dihydro-1H-quinoxaline
SMILESc1ccc2c(c1)NCCN2C1CCCC1
InChIInChI=1S/C13H18N2/c1-2-6-11(5-1)15-10-9-14-12-7-3-4-8-13(12)15/h3-4,7-8,11,14H,1-2,5-6,9-10H2
InChIKeyODYHMBBRAZIQQQ-UHFFFAOYSA-N
XLogP2.86
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-cyclohexyl-2,3-dihydro-1H-quinoxaline
CID 105470427
4-piperidin-3-yl-2,3-dihydro-1H-quinoxaline
CID 117030821
4-(3,4-dihydro-2H-quinoxalin-1-yl)cyclohexan-1-ol
CID 117030865
4-(3,4-dihydro-2H-quinoxalin-1-yl)cyclohexane-1-carboxylic acid
CID 117030843
5,6,6a,7,8,9,10,11-octahydroazepino[1,2-a]quinoxaline
CID 10488339
5-(oxan-4-yl)-1,2,3,4-tetrahydro-1,5-benzodiazepine
CID 64851045
5-cyclohexyl-1,2,3,4-tetrahydro-1,5-benzodiazepin-2-ol
CID 145262182
6-bromo-4-cyclohexyl-2,3-dihydro-1H-quinoxaline
CID 117006433
1-cyclohexyl-3,4-dihydro-2H-quinoxaline-6-carbonitrile
CID 117007237
2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoxaline;dihydrochloride
CID 142652132
5-(2-ethylcyclohexyl)-1,2,3,4-tetrahydro-1,5-benzodiazepine
CID 64852194
3-amino-5-cyclohexyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one
CID 18321635

Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyl-2,3-dihydro-1H-quinoxaline?
The IUPAC name of 4-cyclopentyl-2,3-dihydro-1H-quinoxaline (CID 71683750) is 4-cyclopentyl-2,3-dihydro-1H-quinoxaline.
What is the SMILES notation for 4-cyclopentyl-2,3-dihydro-1H-quinoxaline?
The canonical SMILES for 4-cyclopentyl-2,3-dihydro-1H-quinoxaline is c1ccc2c(c1)NCCN2C1CCCC1.
What is the InChIKey of 4-cyclopentyl-2,3-dihydro-1H-quinoxaline?
The InChIKey is ODYHMBBRAZIQQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2/c1-2-6-11(5-1)15-10-9-14-12-7-3-4-8-13(12)15/h3-4,7-8,11,14H,1-2,5-6,9-10H2.
What are the key properties of 4-cyclopentyl-2,3-dihydro-1H-quinoxaline?
4-cyclopentyl-2,3-dihydro-1H-quinoxaline has a molecular weight of 202.30 g/mol, XLogP of 2.86, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyl-2,3-dihydro-1H-quinoxaline is sourced from PubChem (CID 71683750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).