2-ethyl-4-methyl-6-propan-2-yl-2,3-dihydro-1H-quinoxaline

C14H22N2 — CID 84623191

IUPAC2-ethyl-4-methyl-6-propan-2-yl-2,3-dihydro-1H-quinoxaline
SMILESCCC1CN(C)c2cc(C(C)C)ccc2N1
InChIInChI=1S/C14H22N2/c1-5-12-9-16(4)14-8-11(10(2)3)6-7-13(14)15-12/h6-8,10,12,15H,5,9H2,1-4H3
InChIKeyOHLFIPFFWUNZCB-UHFFFAOYSA-N
MW218.34 g/mol
LogP3.45
Rot. Bonds2

About 2-ethyl-4-methyl-6-propan-2-yl-2,3-dihydro-1H-quinoxaline

2-ethyl-4-methyl-6-propan-2-yl-2,3-dihydro-1H-quinoxaline (PubChem CID 84623191) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is 2-ethyl-4-methyl-6-propan-2-yl-2,3-dihydro-1H-quinoxaline.

Molecular Properties

Compound Name2-ethyl-4-methyl-6-propan-2-yl-2,3-dihydro-1H-quinoxaline
PubChem CID84623191
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC Name2-ethyl-4-methyl-6-propan-2-yl-2,3-dihydro-1H-quinoxaline
SMILESCCC1CN(C)c2cc(C(C)C)ccc2N1
InChIInChI=1S/C14H22N2/c1-5-12-9-16(4)14-8-11(10(2)3)6-7-13(14)15-12/h6-8,10,12,15H,5,9H2,1-4H3
InChIKeyOHLFIPFFWUNZCB-UHFFFAOYSA-N
XLogP3.45
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,4-dimethyl-6-propan-2-yl-2,3-dihydro-1H-quinoxaline
CID 84620450
2-ethyl-6-methoxy-4-methyl-2,3-dihydro-1H-quinoxaline
CID 84620800
3-methyl-5-propan-2-yl-1,2-dihydrobenzimidazole
CID 162748632
4,5-dimethyl-7-propan-2-yl-1,2,3,4-tetrahydro-1,5-benzodiazepine
CID 84623178
1,3-dimethyl-5-propan-2-yl-2H-benzimidazole
CID 134492411
1,4-dimethyl-6-propan-2-yl-2,3-dihydroquinoxaline
CID 58398104
2,5-diethyl-4-methyl-2,3-dihydro-1H-quinoxaline
CID 84620474
7-chloro-2-ethyl-4,5-dimethyl-2,3-dihydro-1H-quinoxaline
CID 84624812
6-chloro-2-ethyl-4,8-dimethyl-2,3-dihydro-1H-quinoxaline
CID 84624811
1-(1-methyl-5-propan-2-yl-2,3-dihydroindol-3-yl)propan-2-amine
CID 82277241
4-[(S)-[3,5-bis(trifluoromethyl)phenyl]-(2-methyltetrazol-5-yl)methyl]-2-ethyl-6-(trifluoromethyl)-2,3-dihydro-1H-quinoxaline
CID 87891901
1-ethyl-4-methyl-7-propan-2-yl-3H-quinoxalin-2-one
CID 153308057

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-4-methyl-6-propan-2-yl-2,3-dihydro-1H-quinoxaline?
The IUPAC name of 2-ethyl-4-methyl-6-propan-2-yl-2,3-dihydro-1H-quinoxaline (CID 84623191) is 2-ethyl-4-methyl-6-propan-2-yl-2,3-dihydro-1H-quinoxaline.
What is the SMILES notation for 2-ethyl-4-methyl-6-propan-2-yl-2,3-dihydro-1H-quinoxaline?
The canonical SMILES for 2-ethyl-4-methyl-6-propan-2-yl-2,3-dihydro-1H-quinoxaline is CCC1CN(C)c2cc(C(C)C)ccc2N1.
What is the InChIKey of 2-ethyl-4-methyl-6-propan-2-yl-2,3-dihydro-1H-quinoxaline?
The InChIKey is OHLFIPFFWUNZCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2/c1-5-12-9-16(4)14-8-11(10(2)3)6-7-13(14)15-12/h6-8,10,12,15H,5,9H2,1-4H3.
What are the key properties of 2-ethyl-4-methyl-6-propan-2-yl-2,3-dihydro-1H-quinoxaline?
2-ethyl-4-methyl-6-propan-2-yl-2,3-dihydro-1H-quinoxaline has a molecular weight of 218.34 g/mol, XLogP of 3.45, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-4-methyl-6-propan-2-yl-2,3-dihydro-1H-quinoxaline is sourced from PubChem (CID 84623191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).