[2-(quinolin-7-yloxymethyl)furan-3-yl]methanamine

C15H14N2O2 — CID 107314996

IUPAC[2-(quinolin-7-yloxymethyl)furan-3-yl]methanamine
SMILESNCc1ccoc1COc1ccc2cccnc2c1
InChIInChI=1S/C15H14N2O2/c16-9-12-5-7-18-15(12)10-19-13-4-3-11-2-1-6-17-14(11)8-13/h1-8H,9-10,16H2
InChIKeyDETDLNNSYPBKPC-UHFFFAOYSA-N
MW254.29 g/mol
LogP2.87
Rot. Bonds4

About [2-(quinolin-7-yloxymethyl)furan-3-yl]methanamine

[2-(quinolin-7-yloxymethyl)furan-3-yl]methanamine (PubChem CID 107314996) has the molecular formula C15H14N2O2 and a molecular weight of 254.29 g/mol. Its IUPAC name is [2-(quinolin-7-yloxymethyl)furan-3-yl]methanamine.

Molecular Properties

Compound Name[2-(quinolin-7-yloxymethyl)furan-3-yl]methanamine
PubChem CID107314996
Molecular FormulaC15H14N2O2
Molecular Weight254.29 g/mol
Exact Mass254.11
IUPAC Name[2-(quinolin-7-yloxymethyl)furan-3-yl]methanamine
SMILESNCc1ccoc1COc1ccc2cccnc2c1
InChIInChI=1S/C15H14N2O2/c16-9-12-5-7-18-15(12)10-19-13-4-3-11-2-1-6-17-14(11)8-13/h1-8H,9-10,16H2
InChIKeyDETDLNNSYPBKPC-UHFFFAOYSA-N
XLogP2.87
TPSA61.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [2-(quinolin-7-yloxymethyl)furan-3-yl]methanamine?
The IUPAC name of [2-(quinolin-7-yloxymethyl)furan-3-yl]methanamine (CID 107314996) is [2-(quinolin-7-yloxymethyl)furan-3-yl]methanamine.
What is the SMILES notation for [2-(quinolin-7-yloxymethyl)furan-3-yl]methanamine?
The canonical SMILES for [2-(quinolin-7-yloxymethyl)furan-3-yl]methanamine is NCc1ccoc1COc1ccc2cccnc2c1.
What is the InChIKey of [2-(quinolin-7-yloxymethyl)furan-3-yl]methanamine?
The InChIKey is DETDLNNSYPBKPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O2/c16-9-12-5-7-18-15(12)10-19-13-4-3-11-2-1-6-17-14(11)8-13/h1-8H,9-10,16H2.
What are the key properties of [2-(quinolin-7-yloxymethyl)furan-3-yl]methanamine?
[2-(quinolin-7-yloxymethyl)furan-3-yl]methanamine has a molecular weight of 254.29 g/mol, XLogP of 2.87, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(quinolin-7-yloxymethyl)furan-3-yl]methanamine is sourced from PubChem (CID 107314996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).