N-(2-ethoxyphenyl)-8-methyltetrazolo[1,5-a]quinoxalin-4-amine

C17H16N6O — CID 22431482

IUPACN-(2-ethoxyphenyl)-8-methyltetrazolo[1,5-a]quinoxalin-4-amine
SMILESCCOc1ccccc1Nc1nc2ccc(C)cc2n2nnnc12
InChIInChI=1S/C17H16N6O/c1-3-24-15-7-5-4-6-13(15)19-16-17-20-21-22-23(17)14-10-11(2)8-9-12(14)18-16/h4-10H,3H2,1-2H3,(H,18,19)
InChIKeyBHPOOWUPZSESIG-UHFFFAOYSA-N
MW320.36 g/mol
LogP3.12
Rot. Bonds4

About N-(2-ethoxyphenyl)-8-methyltetrazolo[1,5-a]quinoxalin-4-amine

N-(2-ethoxyphenyl)-8-methyltetrazolo[1,5-a]quinoxalin-4-amine (PubChem CID 22431482) has the molecular formula C17H16N6O and a molecular weight of 320.36 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)-8-methyltetrazolo[1,5-a]quinoxalin-4-amine.

Molecular Properties

Compound NameN-(2-ethoxyphenyl)-8-methyltetrazolo[1,5-a]quinoxalin-4-amine
PubChem CID22431482
Molecular FormulaC17H16N6O
Molecular Weight320.36 g/mol
Exact Mass320.14
IUPAC NameN-(2-ethoxyphenyl)-8-methyltetrazolo[1,5-a]quinoxalin-4-amine
SMILESCCOc1ccccc1Nc1nc2ccc(C)cc2n2nnnc12
InChIInChI=1S/C17H16N6O/c1-3-24-15-7-5-4-6-13(15)19-16-17-20-21-22-23(17)14-10-11(2)8-9-12(14)18-16/h4-10H,3H2,1-2H3,(H,18,19)
InChIKeyBHPOOWUPZSESIG-UHFFFAOYSA-N
XLogP3.12
TPSA77.23 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.36
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-(3-chloro-4-methoxyphenyl)-8-methyltetrazolo[1,5-a]quinoxalin-4-amine
CID 22431441
N-(2-ethoxyphenyl)tetrazolo[5,1-a]phthalazin-6-amine
CID 20934834
2-(tetrazolo[1,5-a]quinoxalin-4-ylamino)phenol
CID 135458511
5-N,6-N-bis(2-ethoxyphenyl)-[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine
CID 142482627
2,5-dichloro-N-(2-ethoxyphenyl)pyrimidin-4-amine
CID 79632163
N-(2-ethoxyphenyl)-3-methyltriazolo[4,5-d]pyrimidin-7-amine
CID 7659050
N-(2,4-dimethylphenyl)-4-oxa-1,3,5,7,10,11,12-heptazatricyclo[7.3.0.02,6]dodeca-2,5,7,9,11-pentaen-8-amine
CID 4162329
4-N-(2-ethoxyphenyl)-2,5-dimethylpyrimidine-4,6-diamine
CID 80762592
1-ethyl-N-(2-methoxyphenyl)-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine
CID 22432522
4-N-(2-ethoxyphenyl)-2-N-ethyl-2-N-(3-methylphenyl)pyrimidine-2,4-diamine
CID 112904861
2-N-(2,5-dimethylphenyl)-4-N-(2-ethoxyphenyl)pyrimidine-2,4-diamine
CID 112902522
4-N-(2-ethoxyphenyl)quinazoline-2,4-diamine
CID 80738238

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyphenyl)-8-methyltetrazolo[1,5-a]quinoxalin-4-amine?
The IUPAC name of N-(2-ethoxyphenyl)-8-methyltetrazolo[1,5-a]quinoxalin-4-amine (CID 22431482) is N-(2-ethoxyphenyl)-8-methyltetrazolo[1,5-a]quinoxalin-4-amine.
What is the SMILES notation for N-(2-ethoxyphenyl)-8-methyltetrazolo[1,5-a]quinoxalin-4-amine?
The canonical SMILES for N-(2-ethoxyphenyl)-8-methyltetrazolo[1,5-a]quinoxalin-4-amine is CCOc1ccccc1Nc1nc2ccc(C)cc2n2nnnc12.
What is the InChIKey of N-(2-ethoxyphenyl)-8-methyltetrazolo[1,5-a]quinoxalin-4-amine?
The InChIKey is BHPOOWUPZSESIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N6O/c1-3-24-15-7-5-4-6-13(15)19-16-17-20-21-22-23(17)14-10-11(2)8-9-12(14)18-16/h4-10H,3H2,1-2H3,(H,18,19).
What are the key properties of N-(2-ethoxyphenyl)-8-methyltetrazolo[1,5-a]quinoxalin-4-amine?
N-(2-ethoxyphenyl)-8-methyltetrazolo[1,5-a]quinoxalin-4-amine has a molecular weight of 320.36 g/mol, XLogP of 3.12, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyphenyl)-8-methyltetrazolo[1,5-a]quinoxalin-4-amine is sourced from PubChem (CID 22431482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).