2-(2-methoxyethyl)-5-propan-2-yloxy-1,2,3,4-tetrahydroquinoxaline

C14H22N2O2 — CID 113393594

IUPAC2-(2-methoxyethyl)-5-propan-2-yloxy-1,2,3,4-tetrahydroquinoxaline
SMILESCOCCC1CNc2c(cccc2OC(C)C)N1
InChIInChI=1S/C14H22N2O2/c1-10(2)18-13-6-4-5-12-14(13)15-9-11(16-12)7-8-17-3/h4-6,10-11,15-16H,7-9H2,1-3H3
InChIKeyITPOMPNQRNJTMA-UHFFFAOYSA-N
MW250.34 g/mol
LogP2.72
Rot. Bonds5

About 2-(2-methoxyethyl)-5-propan-2-yloxy-1,2,3,4-tetrahydroquinoxaline

2-(2-methoxyethyl)-5-propan-2-yloxy-1,2,3,4-tetrahydroquinoxaline (PubChem CID 113393594) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 2-(2-methoxyethyl)-5-propan-2-yloxy-1,2,3,4-tetrahydroquinoxaline.

Molecular Properties

Compound Name2-(2-methoxyethyl)-5-propan-2-yloxy-1,2,3,4-tetrahydroquinoxaline
PubChem CID113393594
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name2-(2-methoxyethyl)-5-propan-2-yloxy-1,2,3,4-tetrahydroquinoxaline
SMILESCOCCC1CNc2c(cccc2OC(C)C)N1
InChIInChI=1S/C14H22N2O2/c1-10(2)18-13-6-4-5-12-14(13)15-9-11(16-12)7-8-17-3/h4-6,10-11,15-16H,7-9H2,1-3H3
InChIKeyITPOMPNQRNJTMA-UHFFFAOYSA-N
XLogP2.72
TPSA42.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 52.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-bromo-2-(methoxymethyl)-1,2,3,4-tetrahydroquinoxaline
CID 130577854
3-methyl-6-propan-2-yloxy-1,2,3,5-tetrahydro-1,5-benzodiazepin-4-one
CID 113393567
2-(methoxymethyl)-5-methylsulfonyl-1,2,3,4-tetrahydroquinoxaline
CID 82008597
6-propan-2-yloxyspiro[1,3,4,5-tetrahydro-1,5-benzodiazepine-2,1'-cyclobutane]
CID 113393610
6-propan-2-yloxyspiro[2,5-dihydro-1H-1,5-benzodiazepine-3,1'-cyclopropane]-4-one
CID 113393579
1-cyclopropyl-2-propan-2-yloxybenzene
CID 121339492
2-bromo-1,3-di(propan-2-yloxy)benzene
CID 102493711
6-propan-2-yloxy-2,3,3a,5-tetrahydro-1H-pyrrolo[1,2-a]quinoxalin-4-one
CID 113393558
4-[(3R)-3-(2-methoxyethyl)-4-methylpiperazin-1-yl]-2-propan-2-yloxyaniline
CID 129408485
1-(methoxymethyl)-2-propan-2-yloxybenzene
CID 154665726
4-(2-methoxyethyl)-3,4-dihydro-2H-pyrrolo[1,2-a]pyrazin-1-one
CID 73018192
[(2S)-4-methoxy-2,3-dihydro-1H-indol-2-yl]methanol
CID 130665549

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethyl)-5-propan-2-yloxy-1,2,3,4-tetrahydroquinoxaline?
The IUPAC name of 2-(2-methoxyethyl)-5-propan-2-yloxy-1,2,3,4-tetrahydroquinoxaline (CID 113393594) is 2-(2-methoxyethyl)-5-propan-2-yloxy-1,2,3,4-tetrahydroquinoxaline.
What is the SMILES notation for 2-(2-methoxyethyl)-5-propan-2-yloxy-1,2,3,4-tetrahydroquinoxaline?
The canonical SMILES for 2-(2-methoxyethyl)-5-propan-2-yloxy-1,2,3,4-tetrahydroquinoxaline is COCCC1CNc2c(cccc2OC(C)C)N1.
What is the InChIKey of 2-(2-methoxyethyl)-5-propan-2-yloxy-1,2,3,4-tetrahydroquinoxaline?
The InChIKey is ITPOMPNQRNJTMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-10(2)18-13-6-4-5-12-14(13)15-9-11(16-12)7-8-17-3/h4-6,10-11,15-16H,7-9H2,1-3H3.
What are the key properties of 2-(2-methoxyethyl)-5-propan-2-yloxy-1,2,3,4-tetrahydroquinoxaline?
2-(2-methoxyethyl)-5-propan-2-yloxy-1,2,3,4-tetrahydroquinoxaline has a molecular weight of 250.34 g/mol, XLogP of 2.72, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethyl)-5-propan-2-yloxy-1,2,3,4-tetrahydroquinoxaline is sourced from PubChem (CID 113393594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).