1-cyclopropyl-2-quinoxalin-2-ylethanamine

C13H15N3 — CID 63352950

IUPAC1-cyclopropyl-2-quinoxalin-2-ylethanamine
SMILESNC(Cc1cnc2ccccc2n1)C1CC1
InChIInChI=1S/C13H15N3/c14-11(9-5-6-9)7-10-8-15-12-3-1-2-4-13(12)16-10/h1-4,8-9,11H,5-7,14H2
InChIKeyXWRNIMBLIVVDRF-UHFFFAOYSA-N
MW213.28 g/mol
LogP1.91
Rot. Bonds3

About 1-cyclopropyl-2-quinoxalin-2-ylethanamine

1-cyclopropyl-2-quinoxalin-2-ylethanamine (PubChem CID 63352950) has the molecular formula C13H15N3 and a molecular weight of 213.28 g/mol. Its IUPAC name is 1-cyclopropyl-2-quinoxalin-2-ylethanamine.

Molecular Properties

Compound Name1-cyclopropyl-2-quinoxalin-2-ylethanamine
PubChem CID63352950
Molecular FormulaC13H15N3
Molecular Weight213.28 g/mol
Exact Mass213.13
IUPAC Name1-cyclopropyl-2-quinoxalin-2-ylethanamine
SMILESNC(Cc1cnc2ccccc2n1)C1CC1
InChIInChI=1S/C13H15N3/c14-11(9-5-6-9)7-10-8-15-12-3-1-2-4-13(12)16-10/h1-4,8-9,11H,5-7,14H2
InChIKeyXWRNIMBLIVVDRF-UHFFFAOYSA-N
XLogP1.91
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-quinoxalin-2-ylethanamine?
The IUPAC name of 1-cyclopropyl-2-quinoxalin-2-ylethanamine (CID 63352950) is 1-cyclopropyl-2-quinoxalin-2-ylethanamine.
What is the SMILES notation for 1-cyclopropyl-2-quinoxalin-2-ylethanamine?
The canonical SMILES for 1-cyclopropyl-2-quinoxalin-2-ylethanamine is NC(Cc1cnc2ccccc2n1)C1CC1.
What is the InChIKey of 1-cyclopropyl-2-quinoxalin-2-ylethanamine?
The InChIKey is XWRNIMBLIVVDRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3/c14-11(9-5-6-9)7-10-8-15-12-3-1-2-4-13(12)16-10/h1-4,8-9,11H,5-7,14H2.
What are the key properties of 1-cyclopropyl-2-quinoxalin-2-ylethanamine?
1-cyclopropyl-2-quinoxalin-2-ylethanamine has a molecular weight of 213.28 g/mol, XLogP of 1.91, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-quinoxalin-2-ylethanamine is sourced from PubChem (CID 63352950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).