N-[2,3-dihydrofuran-5-yl(quinoxalin-6-yl)methyl]propan-1-amine

C16H19N3O — CID 102651581

IUPACN-[2,3-dihydrofuran-5-yl(quinoxalin-6-yl)methyl]propan-1-amine
SMILESCCCNC(C1=CCCO1)c1ccc2nccnc2c1
InChIInChI=1S/C16H19N3O/c1-2-7-19-16(15-4-3-10-20-15)12-5-6-13-14(11-12)18-9-8-17-13/h4-6,8-9,11,16,19H,2-3,7,10H2,1H3
InChIKeyRMWAZSFCQPLFNR-UHFFFAOYSA-N
MW269.35 g/mol
LogP2.97
Rot. Bonds5

About N-[2,3-dihydrofuran-5-yl(quinoxalin-6-yl)methyl]propan-1-amine

N-[2,3-dihydrofuran-5-yl(quinoxalin-6-yl)methyl]propan-1-amine (PubChem CID 102651581) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is N-[2,3-dihydrofuran-5-yl(quinoxalin-6-yl)methyl]propan-1-amine.

Molecular Properties

Compound NameN-[2,3-dihydrofuran-5-yl(quinoxalin-6-yl)methyl]propan-1-amine
PubChem CID102651581
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC NameN-[2,3-dihydrofuran-5-yl(quinoxalin-6-yl)methyl]propan-1-amine
SMILESCCCNC(C1=CCCO1)c1ccc2nccnc2c1
InChIInChI=1S/C16H19N3O/c1-2-7-19-16(15-4-3-10-20-15)12-5-6-13-14(11-12)18-9-8-17-13/h4-6,8-9,11,16,19H,2-3,7,10H2,1H3
InChIKeyRMWAZSFCQPLFNR-UHFFFAOYSA-N
XLogP2.97
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[2,3-dihydrofuran-5-yl(quinoxalin-6-yl)methyl]propan-1-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

N-[2,3-dihydrofuran-5-yl(quinolin-6-yl)methyl]ethanamine
CID 102651527
N-[2,3-dihydrofuran-5-yl-(3,4,5-trifluorophenyl)methyl]propan-1-amine
CID 102651379
N-[2,3-dihydrofuran-5-yl-(2,3,4,5,6-pentafluorophenyl)methyl]propan-1-amine
CID 102653283
N-[2,3-dihydrofuran-5-yl-(2,5-dimethylphenyl)methyl]propan-1-amine
CID 102653281
N-[2,3-dihydrofuran-5-yl-(2,4,6-trimethylphenyl)methyl]propan-1-amine
CID 102653514
N-[2,3-dihydrofuran-5-yl(furan-2-yl)methyl]propan-1-amine
CID 102651455
N-[1-benzofuran-2-yl(2,3-dihydrofuran-5-yl)methyl]propan-1-amine
CID 102651524
N-[(3-methyltriazol-4-yl)-quinoxalin-6-ylmethyl]propan-1-amine
CID 114687811
N-[3,4-dihydro-2H-pyran-6-yl-(3-fluorophenyl)methyl]propan-1-amine
CID 102647099
N-[(4-bromothiophen-3-yl)-quinoxalin-6-ylmethyl]propan-1-amine
CID 79590361
N-[(5-bromo-2-methylphenyl)-(2,3-dihydrofuran-5-yl)methyl]propan-1-amine
CID 102653170
N-[(2,5-dichlorophenyl)-(2,3-dihydrofuran-5-yl)methyl]propan-1-amine
CID 102653631

Frequently Asked Questions

What is the IUPAC name of N-[2,3-dihydrofuran-5-yl(quinoxalin-6-yl)methyl]propan-1-amine?
The IUPAC name of N-[2,3-dihydrofuran-5-yl(quinoxalin-6-yl)methyl]propan-1-amine (CID 102651581) is N-[2,3-dihydrofuran-5-yl(quinoxalin-6-yl)methyl]propan-1-amine.
What is the SMILES notation for N-[2,3-dihydrofuran-5-yl(quinoxalin-6-yl)methyl]propan-1-amine?
The canonical SMILES for N-[2,3-dihydrofuran-5-yl(quinoxalin-6-yl)methyl]propan-1-amine is CCCNC(C1=CCCO1)c1ccc2nccnc2c1.
What is the InChIKey of N-[2,3-dihydrofuran-5-yl(quinoxalin-6-yl)methyl]propan-1-amine?
The InChIKey is RMWAZSFCQPLFNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c1-2-7-19-16(15-4-3-10-20-15)12-5-6-13-14(11-12)18-9-8-17-13/h4-6,8-9,11,16,19H,2-3,7,10H2,1H3.
What are the key properties of N-[2,3-dihydrofuran-5-yl(quinoxalin-6-yl)methyl]propan-1-amine?
N-[2,3-dihydrofuran-5-yl(quinoxalin-6-yl)methyl]propan-1-amine has a molecular weight of 269.35 g/mol, XLogP of 2.97, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2,3-dihydrofuran-5-yl(quinoxalin-6-yl)methyl]propan-1-amine is sourced from PubChem (CID 102651581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).