N-[1-(5-quinolin-5-ylfuran-2-yl)ethyl]propan-1-amine

C18H20N2O — CID 62500349

IUPACN-[1-(5-quinolin-5-ylfuran-2-yl)ethyl]propan-1-amine
SMILESCCCNC(C)c1ccc(-c2cccc3ncccc23)o1
InChIInChI=1S/C18H20N2O/c1-3-11-19-13(2)17-9-10-18(21-17)15-6-4-8-16-14(15)7-5-12-20-16/h4-10,12-13,19H,3,11H2,1-2H3
InChIKeyXLTMZKSMHLITNP-UHFFFAOYSA-N
MW280.37 g/mol
LogP4.56
Rot. Bonds5

About N-[1-(5-quinolin-5-ylfuran-2-yl)ethyl]propan-1-amine

N-[1-(5-quinolin-5-ylfuran-2-yl)ethyl]propan-1-amine (PubChem CID 62500349) has the molecular formula C18H20N2O and a molecular weight of 280.37 g/mol. Its IUPAC name is N-[1-(5-quinolin-5-ylfuran-2-yl)ethyl]propan-1-amine.

Molecular Properties

Compound NameN-[1-(5-quinolin-5-ylfuran-2-yl)ethyl]propan-1-amine
PubChem CID62500349
Molecular FormulaC18H20N2O
Molecular Weight280.37 g/mol
Exact Mass280.16
IUPAC NameN-[1-(5-quinolin-5-ylfuran-2-yl)ethyl]propan-1-amine
SMILESCCCNC(C)c1ccc(-c2cccc3ncccc23)o1
InChIInChI=1S/C18H20N2O/c1-3-11-19-13(2)17-9-10-18(21-17)15-6-4-8-16-14(15)7-5-12-20-16/h4-10,12-13,19H,3,11H2,1-2H3
InChIKeyXLTMZKSMHLITNP-UHFFFAOYSA-N
XLogP4.56
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 54.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[1-(5-quinolin-5-ylfuran-2-yl)ethyl]propan-1-amine?
The IUPAC name of N-[1-(5-quinolin-5-ylfuran-2-yl)ethyl]propan-1-amine (CID 62500349) is N-[1-(5-quinolin-5-ylfuran-2-yl)ethyl]propan-1-amine.
What is the SMILES notation for N-[1-(5-quinolin-5-ylfuran-2-yl)ethyl]propan-1-amine?
The canonical SMILES for N-[1-(5-quinolin-5-ylfuran-2-yl)ethyl]propan-1-amine is CCCNC(C)c1ccc(-c2cccc3ncccc23)o1.
What is the InChIKey of N-[1-(5-quinolin-5-ylfuran-2-yl)ethyl]propan-1-amine?
The InChIKey is XLTMZKSMHLITNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O/c1-3-11-19-13(2)17-9-10-18(21-17)15-6-4-8-16-14(15)7-5-12-20-16/h4-10,12-13,19H,3,11H2,1-2H3.
What are the key properties of N-[1-(5-quinolin-5-ylfuran-2-yl)ethyl]propan-1-amine?
N-[1-(5-quinolin-5-ylfuran-2-yl)ethyl]propan-1-amine has a molecular weight of 280.37 g/mol, XLogP of 4.56, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(5-quinolin-5-ylfuran-2-yl)ethyl]propan-1-amine is sourced from PubChem (CID 62500349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).