N-methyl-1-(5-quinoxalin-6-ylfuran-2-yl)propan-2-amine

C16H17N3O — CID 63086159

IUPACN-methyl-1-(5-quinoxalin-6-ylfuran-2-yl)propan-2-amine
SMILESCNC(C)Cc1ccc(-c2ccc3nccnc3c2)o1
InChIInChI=1S/C16H17N3O/c1-11(17-2)9-13-4-6-16(20-13)12-3-5-14-15(10-12)19-8-7-18-14/h3-8,10-11,17H,9H2,1-2H3
InChIKeyDABUECRHWGDOQC-UHFFFAOYSA-N
MW267.33 g/mol
LogP3.04
Rot. Bonds4

About N-methyl-1-(5-quinoxalin-6-ylfuran-2-yl)propan-2-amine

N-methyl-1-(5-quinoxalin-6-ylfuran-2-yl)propan-2-amine (PubChem CID 63086159) has the molecular formula C16H17N3O and a molecular weight of 267.33 g/mol. Its IUPAC name is N-methyl-1-(5-quinoxalin-6-ylfuran-2-yl)propan-2-amine.

Molecular Properties

Compound NameN-methyl-1-(5-quinoxalin-6-ylfuran-2-yl)propan-2-amine
PubChem CID63086159
Molecular FormulaC16H17N3O
Molecular Weight267.33 g/mol
Exact Mass267.14
IUPAC NameN-methyl-1-(5-quinoxalin-6-ylfuran-2-yl)propan-2-amine
SMILESCNC(C)Cc1ccc(-c2ccc3nccnc3c2)o1
InChIInChI=1S/C16H17N3O/c1-11(17-2)9-13-4-6-16(20-13)12-3-5-14-15(10-12)19-8-7-18-14/h3-8,10-11,17H,9H2,1-2H3
InChIKeyDABUECRHWGDOQC-UHFFFAOYSA-N
XLogP3.04
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(5-quinoxalin-6-ylfuran-2-yl)propan-2-amine?
The IUPAC name of N-methyl-1-(5-quinoxalin-6-ylfuran-2-yl)propan-2-amine (CID 63086159) is N-methyl-1-(5-quinoxalin-6-ylfuran-2-yl)propan-2-amine.
What is the SMILES notation for N-methyl-1-(5-quinoxalin-6-ylfuran-2-yl)propan-2-amine?
The canonical SMILES for N-methyl-1-(5-quinoxalin-6-ylfuran-2-yl)propan-2-amine is CNC(C)Cc1ccc(-c2ccc3nccnc3c2)o1.
What is the InChIKey of N-methyl-1-(5-quinoxalin-6-ylfuran-2-yl)propan-2-amine?
The InChIKey is DABUECRHWGDOQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O/c1-11(17-2)9-13-4-6-16(20-13)12-3-5-14-15(10-12)19-8-7-18-14/h3-8,10-11,17H,9H2,1-2H3.
What are the key properties of N-methyl-1-(5-quinoxalin-6-ylfuran-2-yl)propan-2-amine?
N-methyl-1-(5-quinoxalin-6-ylfuran-2-yl)propan-2-amine has a molecular weight of 267.33 g/mol, XLogP of 3.04, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(5-quinoxalin-6-ylfuran-2-yl)propan-2-amine is sourced from PubChem (CID 63086159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).