N-ethyl-5,6,7,8-tetrahydroquinoxalin-2-amine

C10H15N3 — CID 130568544

IUPACN-ethyl-5,6,7,8-tetrahydroquinoxalin-2-amine
SMILESCCNc1cnc2c(n1)CCCC2
InChIInChI=1S/C10H15N3/c1-2-11-10-7-12-8-5-3-4-6-9(8)13-10/h7H,2-6H2,1H3,(H,11,13)
InChIKeyTXXBOAIBODBMAP-UHFFFAOYSA-N
MW177.25 g/mol
LogP1.79
Rot. Bonds2

About N-ethyl-5,6,7,8-tetrahydroquinoxalin-2-amine

N-ethyl-5,6,7,8-tetrahydroquinoxalin-2-amine (PubChem CID 130568544) has the molecular formula C10H15N3 and a molecular weight of 177.25 g/mol. Its IUPAC name is N-ethyl-5,6,7,8-tetrahydroquinoxalin-2-amine.

Molecular Properties

Compound NameN-ethyl-5,6,7,8-tetrahydroquinoxalin-2-amine
PubChem CID130568544
Molecular FormulaC10H15N3
Molecular Weight177.25 g/mol
Exact Mass177.13
IUPAC NameN-ethyl-5,6,7,8-tetrahydroquinoxalin-2-amine
SMILESCCNc1cnc2c(n1)CCCC2
InChIInChI=1S/C10H15N3/c1-2-11-10-7-12-8-5-3-4-6-9(8)13-10/h7H,2-6H2,1H3,(H,11,13)
InChIKeyTXXBOAIBODBMAP-UHFFFAOYSA-N
XLogP1.79
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-5,6,7,8-tetrahydroquinoxalin-2-amine?
The IUPAC name of N-ethyl-5,6,7,8-tetrahydroquinoxalin-2-amine (CID 130568544) is N-ethyl-5,6,7,8-tetrahydroquinoxalin-2-amine.
What is the SMILES notation for N-ethyl-5,6,7,8-tetrahydroquinoxalin-2-amine?
The canonical SMILES for N-ethyl-5,6,7,8-tetrahydroquinoxalin-2-amine is CCNc1cnc2c(n1)CCCC2.
What is the InChIKey of N-ethyl-5,6,7,8-tetrahydroquinoxalin-2-amine?
The InChIKey is TXXBOAIBODBMAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3/c1-2-11-10-7-12-8-5-3-4-6-9(8)13-10/h7H,2-6H2,1H3,(H,11,13).
What are the key properties of N-ethyl-5,6,7,8-tetrahydroquinoxalin-2-amine?
N-ethyl-5,6,7,8-tetrahydroquinoxalin-2-amine has a molecular weight of 177.25 g/mol, XLogP of 1.79, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5,6,7,8-tetrahydroquinoxalin-2-amine is sourced from PubChem (CID 130568544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).