2-(1,4,7-trimethyl-2,3-dihydroquinoxalin-2-yl)ethanamine

C13H21N3 — CID 84623417

IUPAC2-(1,4,7-trimethyl-2,3-dihydroquinoxalin-2-yl)ethanamine
SMILESCc1ccc2c(c1)N(C)C(CCN)CN2C
InChIInChI=1S/C13H21N3/c1-10-4-5-12-13(8-10)16(3)11(6-7-14)9-15(12)2/h4-5,8,11H,6-7,9,14H2,1-3H3
InChIKeyAMOONRVBKCJWKD-UHFFFAOYSA-N
MW219.33 g/mol
LogP1.60
Rot. Bonds2

About 2-(1,4,7-trimethyl-2,3-dihydroquinoxalin-2-yl)ethanamine

2-(1,4,7-trimethyl-2,3-dihydroquinoxalin-2-yl)ethanamine (PubChem CID 84623417) has the molecular formula C13H21N3 and a molecular weight of 219.33 g/mol. Its IUPAC name is 2-(1,4,7-trimethyl-2,3-dihydroquinoxalin-2-yl)ethanamine.

Molecular Properties

Compound Name2-(1,4,7-trimethyl-2,3-dihydroquinoxalin-2-yl)ethanamine
PubChem CID84623417
Molecular FormulaC13H21N3
Molecular Weight219.33 g/mol
Exact Mass219.17
IUPAC Name2-(1,4,7-trimethyl-2,3-dihydroquinoxalin-2-yl)ethanamine
SMILESCc1ccc2c(c1)N(C)C(CCN)CN2C
InChIInChI=1S/C13H21N3/c1-10-4-5-12-13(8-10)16(3)11(6-7-14)9-15(12)2/h4-5,8,11H,6-7,9,14H2,1-3H3
InChIKeyAMOONRVBKCJWKD-UHFFFAOYSA-N
XLogP1.60
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(8-chloro-1,4,6-trimethyl-2,3-dihydroquinoxalin-2-yl)ethanamine
CID 84635088
2-(5-chloro-1-methyl-2,3-dihydroindol-2-yl)ethanamine
CID 83868700
4,6-dimethyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide
CID 173096627
ethane;1,4,6-trimethyl-2,3-dihydroquinoxaline
CID 91027227
(5-chloro-1,4,7-trimethyl-2,3-dihydroquinoxalin-2-yl)methanamine
CID 84629598
(3R,4S)-3-amino-1,6-dimethyl-3,4-dihydro-2H-quinolin-4-ol
CID 97028375
2-(1-methyl-3,4-dihydro-2H-quinolin-2-yl)ethanamine
CID 84618930
2-(7-fluoro-4-methyl-2,3-dihydro-1,4-benzoxazin-3-yl)ethanamine
CID 84621374
2-(6-tert-butyl-1-methyl-3,4-dihydro-2H-quinolin-2-yl)ethanamine
CID 84632621
4-(2-aminoethyl)-1,6-dimethyl-3,4-dihydroquinolin-2-one
CID 84622894
4-(2-aminoethyl)-1,7-dimethyl-3,4-dihydroquinolin-2-one
CID 84622908
1-[2-(aminomethyl)-4-methylphenyl]pyrrolidine-3,4-diol
CID 107926386

Frequently Asked Questions

What is the IUPAC name of 2-(1,4,7-trimethyl-2,3-dihydroquinoxalin-2-yl)ethanamine?
The IUPAC name of 2-(1,4,7-trimethyl-2,3-dihydroquinoxalin-2-yl)ethanamine (CID 84623417) is 2-(1,4,7-trimethyl-2,3-dihydroquinoxalin-2-yl)ethanamine.
What is the SMILES notation for 2-(1,4,7-trimethyl-2,3-dihydroquinoxalin-2-yl)ethanamine?
The canonical SMILES for 2-(1,4,7-trimethyl-2,3-dihydroquinoxalin-2-yl)ethanamine is Cc1ccc2c(c1)N(C)C(CCN)CN2C.
What is the InChIKey of 2-(1,4,7-trimethyl-2,3-dihydroquinoxalin-2-yl)ethanamine?
The InChIKey is AMOONRVBKCJWKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3/c1-10-4-5-12-13(8-10)16(3)11(6-7-14)9-15(12)2/h4-5,8,11H,6-7,9,14H2,1-3H3.
What are the key properties of 2-(1,4,7-trimethyl-2,3-dihydroquinoxalin-2-yl)ethanamine?
2-(1,4,7-trimethyl-2,3-dihydroquinoxalin-2-yl)ethanamine has a molecular weight of 219.33 g/mol, XLogP of 1.60, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,4,7-trimethyl-2,3-dihydroquinoxalin-2-yl)ethanamine is sourced from PubChem (CID 84623417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).