(3-quinoxalin-6-ylphenyl)methanamine

C15H13N3 — CID 68623609

IUPAC(3-quinoxalin-6-ylphenyl)methanamine
SMILESNCc1cccc(-c2ccc3nccnc3c2)c1
InChIInChI=1S/C15H13N3/c16-10-11-2-1-3-12(8-11)13-4-5-14-15(9-13)18-7-6-17-14/h1-9H,10,16H2
InChIKeyXHJRIERYHJCVLV-UHFFFAOYSA-N
MW235.29 g/mol
LogP2.76
Rot. Bonds2

About (3-quinoxalin-6-ylphenyl)methanamine

(3-quinoxalin-6-ylphenyl)methanamine (PubChem CID 68623609) has the molecular formula C15H13N3 and a molecular weight of 235.29 g/mol. Its IUPAC name is (3-quinoxalin-6-ylphenyl)methanamine.

Molecular Properties

Compound Name(3-quinoxalin-6-ylphenyl)methanamine
PubChem CID68623609
Molecular FormulaC15H13N3
Molecular Weight235.29 g/mol
Exact Mass235.11
IUPAC Name(3-quinoxalin-6-ylphenyl)methanamine
SMILESNCc1cccc(-c2ccc3nccnc3c2)c1
InChIInChI=1S/C15H13N3/c16-10-11-2-1-3-12(8-11)13-4-5-14-15(9-13)18-7-6-17-14/h1-9H,10,16H2
InChIKeyXHJRIERYHJCVLV-UHFFFAOYSA-N
XLogP2.76
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3-quinoxalin-6-ylphenyl)methanamine?
The IUPAC name of (3-quinoxalin-6-ylphenyl)methanamine (CID 68623609) is (3-quinoxalin-6-ylphenyl)methanamine.
What is the SMILES notation for (3-quinoxalin-6-ylphenyl)methanamine?
The canonical SMILES for (3-quinoxalin-6-ylphenyl)methanamine is NCc1cccc(-c2ccc3nccnc3c2)c1.
What is the InChIKey of (3-quinoxalin-6-ylphenyl)methanamine?
The InChIKey is XHJRIERYHJCVLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3/c16-10-11-2-1-3-12(8-11)13-4-5-14-15(9-13)18-7-6-17-14/h1-9H,10,16H2.
What are the key properties of (3-quinoxalin-6-ylphenyl)methanamine?
(3-quinoxalin-6-ylphenyl)methanamine has a molecular weight of 235.29 g/mol, XLogP of 2.76, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-quinoxalin-6-ylphenyl)methanamine is sourced from PubChem (CID 68623609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).