6-methyl-1-propan-2-yl-3,4-dihydroquinoxalin-2-one

C12H16N2O — CID 83509588

IUPAC6-methyl-1-propan-2-yl-3,4-dihydroquinoxalin-2-one
SMILESCc1ccc2c(c1)NCC(=O)N2C(C)C
InChIInChI=1S/C12H16N2O/c1-8(2)14-11-5-4-9(3)6-10(11)13-7-12(14)15/h4-6,8,13H,7H2,1-3H3
InChIKeyZDWRAZGBFHTXLQ-UHFFFAOYSA-N
MW204.27 g/mol
LogP2.16
Rot. Bonds1

About 6-methyl-1-propan-2-yl-3,4-dihydroquinoxalin-2-one

6-methyl-1-propan-2-yl-3,4-dihydroquinoxalin-2-one (PubChem CID 83509588) has the molecular formula C12H16N2O and a molecular weight of 204.27 g/mol. Its IUPAC name is 6-methyl-1-propan-2-yl-3,4-dihydroquinoxalin-2-one.

Molecular Properties

Compound Name6-methyl-1-propan-2-yl-3,4-dihydroquinoxalin-2-one
PubChem CID83509588
Molecular FormulaC12H16N2O
Molecular Weight204.27 g/mol
Exact Mass204.13
IUPAC Name6-methyl-1-propan-2-yl-3,4-dihydroquinoxalin-2-one
SMILESCc1ccc2c(c1)NCC(=O)N2C(C)C
InChIInChI=1S/C12H16N2O/c1-8(2)14-11-5-4-9(3)6-10(11)13-7-12(14)15/h4-6,8,13H,7H2,1-3H3
InChIKeyZDWRAZGBFHTXLQ-UHFFFAOYSA-N
XLogP2.16
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-amino-1-propan-2-yl-3,4-dihydroquinoxalin-2-one
CID 28693556
6-chloro-7-cyclopropyl-1-propan-2-yl-3,4-dihydroquinoxalin-2-one
CID 155027483
7-chloro-5-methyl-1-propan-2-yl-3,4-dihydroquinoxalin-2-one
CID 84629283
7-chloro-8-methyl-1-propan-2-yl-3,4-dihydroquinoxalin-2-one
CID 84629266
8-fluoro-1-propan-2-yl-3,4-dihydroquinoxalin-2-one
CID 84621075
6-methyl-1-propan-2-ylindole-2,3-dione
CID 83753507
deuterium monohydride;2-methylidene-3-propan-2-ylimidazolidin-4-one
CID 159139539
1-(2-bromo-4-methylphenyl)-1,4-diazepane-2,5-dione
CID 64962058
7-bromo-4-methyl-1-propan-2-yl-3H-quinoxalin-2-one
CID 117006371
6-amino-1-methyl-3,4-dihydroquinoxalin-2-one
CID 28693613
1-(2-bromo-5-methylphenyl)piperazine-2,5-dione
CID 82758291
1,6-dimethyl-3-propan-2-yl-3,4-dihydroquinoxalin-2-one
CID 84622977

Frequently Asked Questions

What is the IUPAC name of 6-methyl-1-propan-2-yl-3,4-dihydroquinoxalin-2-one?
The IUPAC name of 6-methyl-1-propan-2-yl-3,4-dihydroquinoxalin-2-one (CID 83509588) is 6-methyl-1-propan-2-yl-3,4-dihydroquinoxalin-2-one.
What is the SMILES notation for 6-methyl-1-propan-2-yl-3,4-dihydroquinoxalin-2-one?
The canonical SMILES for 6-methyl-1-propan-2-yl-3,4-dihydroquinoxalin-2-one is Cc1ccc2c(c1)NCC(=O)N2C(C)C.
What is the InChIKey of 6-methyl-1-propan-2-yl-3,4-dihydroquinoxalin-2-one?
The InChIKey is ZDWRAZGBFHTXLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O/c1-8(2)14-11-5-4-9(3)6-10(11)13-7-12(14)15/h4-6,8,13H,7H2,1-3H3.
What are the key properties of 6-methyl-1-propan-2-yl-3,4-dihydroquinoxalin-2-one?
6-methyl-1-propan-2-yl-3,4-dihydroquinoxalin-2-one has a molecular weight of 204.27 g/mol, XLogP of 2.16, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-1-propan-2-yl-3,4-dihydroquinoxalin-2-one is sourced from PubChem (CID 83509588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).