2-(3-methylquinoxalin-2-yl)-1-benzofuran-3-amine

C17H13N3O — CID 15066325

IUPAC2-(3-methylquinoxalin-2-yl)-1-benzofuran-3-amine
SMILESCc1nc2ccccc2nc1-c1oc2ccccc2c1N
InChIInChI=1S/C17H13N3O/c1-10-16(20-13-8-4-3-7-12(13)19-10)17-15(18)11-6-2-5-9-14(11)21-17/h2-9H,18H2,1H3
InChIKeyDWJKGFZCTWKAID-UHFFFAOYSA-N
MW275.31 g/mol
LogP3.93
Rot. Bonds1

About 2-(3-methylquinoxalin-2-yl)-1-benzofuran-3-amine

2-(3-methylquinoxalin-2-yl)-1-benzofuran-3-amine (PubChem CID 15066325) has the molecular formula C17H13N3O and a molecular weight of 275.31 g/mol. Its IUPAC name is 2-(3-methylquinoxalin-2-yl)-1-benzofuran-3-amine.

Molecular Properties

Compound Name2-(3-methylquinoxalin-2-yl)-1-benzofuran-3-amine
PubChem CID15066325
Molecular FormulaC17H13N3O
Molecular Weight275.31 g/mol
Exact Mass275.11
IUPAC Name2-(3-methylquinoxalin-2-yl)-1-benzofuran-3-amine
SMILESCc1nc2ccccc2nc1-c1oc2ccccc2c1N
InChIInChI=1S/C17H13N3O/c1-10-16(20-13-8-4-3-7-12(13)19-10)17-15(18)11-6-2-5-9-14(11)21-17/h2-9H,18H2,1H3
InChIKeyDWJKGFZCTWKAID-UHFFFAOYSA-N
XLogP3.93
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.31
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(3-methylquinoxalin-2-yl)-1-benzofuran-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-phenyl-1-benzofuran-3-amine
CID 54532541
2-(4-methoxyphenyl)-1-benzofuran-3-amine
CID 102535586
3-dibenzofuran-4-yl-2-methylbenzo[g]quinoxaline
CID 159945205
[1]benzofuro[3,2-b]quinolin-11-amine
CID 143056669
4-(3-methyl-1-benzofuran-2-yl)-1,3-thiazol-2-amine
CID 8878295
5-(3-methylquinoxalin-2-yl)-1H-pyrazol-3-amine
CID 67408304
3-bromo-2-methylquinolin-4-amine;hydrochloride
CID 3022129
2-methyl-3-quinoxalin-2-ylquinoxaline
CID 171905215
6-bromobenzo[a]phenoxazin-5-one
CID 12933237
2-dibenzofuran-3-yl-3-propan-2-ylquinoxaline
CID 163829279
(1S)-1-(4-amino-2-methylquinolin-3-yl)ethanol
CID 920146
ethane;11-methyl-[1]benzofuro[3,2-b]quinoline
CID 143798134

Frequently Asked Questions

What is the IUPAC name of 2-(3-methylquinoxalin-2-yl)-1-benzofuran-3-amine?
The IUPAC name of 2-(3-methylquinoxalin-2-yl)-1-benzofuran-3-amine (CID 15066325) is 2-(3-methylquinoxalin-2-yl)-1-benzofuran-3-amine.
What is the SMILES notation for 2-(3-methylquinoxalin-2-yl)-1-benzofuran-3-amine?
The canonical SMILES for 2-(3-methylquinoxalin-2-yl)-1-benzofuran-3-amine is Cc1nc2ccccc2nc1-c1oc2ccccc2c1N.
What is the InChIKey of 2-(3-methylquinoxalin-2-yl)-1-benzofuran-3-amine?
The InChIKey is DWJKGFZCTWKAID-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13N3O/c1-10-16(20-13-8-4-3-7-12(13)19-10)17-15(18)11-6-2-5-9-14(11)21-17/h2-9H,18H2,1H3.
What are the key properties of 2-(3-methylquinoxalin-2-yl)-1-benzofuran-3-amine?
2-(3-methylquinoxalin-2-yl)-1-benzofuran-3-amine has a molecular weight of 275.31 g/mol, XLogP of 3.93, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylquinoxalin-2-yl)-1-benzofuran-3-amine is sourced from PubChem (CID 15066325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).