N-[(6-fluoroquinolin-8-yl)methyl]-1-(furan-2-yl)-N-(furan-2-ylmethyl)methanamine

C20H17FN2O2 — CID 33195480

IUPACN-[(6-fluoroquinolin-8-yl)methyl]-1-(furan-2-yl)-N-(furan-2-ylmethyl)methanamine
SMILESFc1cc(CN(Cc2ccco2)Cc2ccco2)c2ncccc2c1
InChIInChI=1S/C20H17FN2O2/c21-17-10-15-4-1-7-22-20(15)16(11-17)12-23(13-18-5-2-8-24-18)14-19-6-3-9-25-19/h1-11H,12-14H2
InChIKeyLVDXKDAQRMSNPF-UHFFFAOYSA-N
MW336.37 g/mol
LogP4.76
Rot. Bonds6

About N-[(6-fluoroquinolin-8-yl)methyl]-1-(furan-2-yl)-N-(furan-2-ylmethyl)methanamine

N-[(6-fluoroquinolin-8-yl)methyl]-1-(furan-2-yl)-N-(furan-2-ylmethyl)methanamine (PubChem CID 33195480) has the molecular formula C20H17FN2O2 and a molecular weight of 336.37 g/mol. Its IUPAC name is N-[(6-fluoroquinolin-8-yl)methyl]-1-(furan-2-yl)-N-(furan-2-ylmethyl)methanamine.

Molecular Properties

Compound NameN-[(6-fluoroquinolin-8-yl)methyl]-1-(furan-2-yl)-N-(furan-2-ylmethyl)methanamine
PubChem CID33195480
Molecular FormulaC20H17FN2O2
Molecular Weight336.37 g/mol
Exact Mass336.13
IUPAC NameN-[(6-fluoroquinolin-8-yl)methyl]-1-(furan-2-yl)-N-(furan-2-ylmethyl)methanamine
SMILESFc1cc(CN(Cc2ccco2)Cc2ccco2)c2ncccc2c1
InChIInChI=1S/C20H17FN2O2/c21-17-10-15-4-1-7-22-20(15)16(11-17)12-23(13-18-5-2-8-24-18)14-19-6-3-9-25-19/h1-11H,12-14H2
InChIKeyLVDXKDAQRMSNPF-UHFFFAOYSA-N
XLogP4.76
TPSA42.41 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.37
LogP ≤ 54.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(6-fluoroquinolin-8-yl)methyl]-1-(furan-2-yl)-N-(furan-2-ylmethyl)methanamine?
The IUPAC name of N-[(6-fluoroquinolin-8-yl)methyl]-1-(furan-2-yl)-N-(furan-2-ylmethyl)methanamine (CID 33195480) is N-[(6-fluoroquinolin-8-yl)methyl]-1-(furan-2-yl)-N-(furan-2-ylmethyl)methanamine.
What is the SMILES notation for N-[(6-fluoroquinolin-8-yl)methyl]-1-(furan-2-yl)-N-(furan-2-ylmethyl)methanamine?
The canonical SMILES for N-[(6-fluoroquinolin-8-yl)methyl]-1-(furan-2-yl)-N-(furan-2-ylmethyl)methanamine is Fc1cc(CN(Cc2ccco2)Cc2ccco2)c2ncccc2c1.
What is the InChIKey of N-[(6-fluoroquinolin-8-yl)methyl]-1-(furan-2-yl)-N-(furan-2-ylmethyl)methanamine?
The InChIKey is LVDXKDAQRMSNPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17FN2O2/c21-17-10-15-4-1-7-22-20(15)16(11-17)12-23(13-18-5-2-8-24-18)14-19-6-3-9-25-19/h1-11H,12-14H2.
What are the key properties of N-[(6-fluoroquinolin-8-yl)methyl]-1-(furan-2-yl)-N-(furan-2-ylmethyl)methanamine?
N-[(6-fluoroquinolin-8-yl)methyl]-1-(furan-2-yl)-N-(furan-2-ylmethyl)methanamine has a molecular weight of 336.37 g/mol, XLogP of 4.76, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-fluoroquinolin-8-yl)methyl]-1-(furan-2-yl)-N-(furan-2-ylmethyl)methanamine is sourced from PubChem (CID 33195480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).