[2-methyl-5-(quinolin-7-yloxymethyl)furan-3-yl]methanamine

C16H16N2O2 — CID 107315020

IUPAC[2-methyl-5-(quinolin-7-yloxymethyl)furan-3-yl]methanamine
SMILESCc1oc(COc2ccc3cccnc3c2)cc1CN
InChIInChI=1S/C16H16N2O2/c1-11-13(9-17)7-15(20-11)10-19-14-5-4-12-3-2-6-18-16(12)8-14/h2-8H,9-10,17H2,1H3
InChIKeyWCXYIOITWWUQSX-UHFFFAOYSA-N
MW268.32 g/mol
LogP3.17
Rot. Bonds4

About [2-methyl-5-(quinolin-7-yloxymethyl)furan-3-yl]methanamine

[2-methyl-5-(quinolin-7-yloxymethyl)furan-3-yl]methanamine (PubChem CID 107315020) has the molecular formula C16H16N2O2 and a molecular weight of 268.32 g/mol. Its IUPAC name is [2-methyl-5-(quinolin-7-yloxymethyl)furan-3-yl]methanamine.

Molecular Properties

Compound Name[2-methyl-5-(quinolin-7-yloxymethyl)furan-3-yl]methanamine
PubChem CID107315020
Molecular FormulaC16H16N2O2
Molecular Weight268.32 g/mol
Exact Mass268.12
IUPAC Name[2-methyl-5-(quinolin-7-yloxymethyl)furan-3-yl]methanamine
SMILESCc1oc(COc2ccc3cccnc3c2)cc1CN
InChIInChI=1S/C16H16N2O2/c1-11-13(9-17)7-15(20-11)10-19-14-5-4-12-3-2-6-18-16(12)8-14/h2-8H,9-10,17H2,1H3
InChIKeyWCXYIOITWWUQSX-UHFFFAOYSA-N
XLogP3.17
TPSA61.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[2-methyl-5-(pyridin-3-yloxymethyl)furan-3-yl]methanamine
CID 62449563
[3-methyl-4-(quinolin-7-yloxymethyl)phenyl]methanamine
CID 107313344
[2-(quinolin-7-yloxymethyl)furan-3-yl]methanamine
CID 107314996
[2-methyl-5-[[4-(trifluoromethyl)phenoxy]methyl]furan-3-yl]methanamine
CID 62441296
5-fluoro-2-(quinolin-7-yloxymethyl)aniline
CID 107313267
7-[(2-chlorophenyl)methoxy]quinoline
CID 91807412
3-methyl-5-(quinolin-6-yloxymethyl)-1,2-oxazole
CID 56820803
3-(quinolin-7-yloxymethyl)pyridine-2-carbothioamide
CID 107313737
N-methyl-1-[2-(quinolin-7-yloxymethyl)phenyl]methanamine
CID 107314976
[5-[(2-chlorophenoxy)methyl]-2-methylfuran-3-yl]methanamine
CID 62453737
N-methyl-1-[6-(quinolin-7-yloxymethyl)-2-pyridinyl]methanamine
CID 107315161
1-amino-2-methyl-3-quinolin-7-yloxypropan-2-ol
CID 107315662

Frequently Asked Questions

What is the IUPAC name of [2-methyl-5-(quinolin-7-yloxymethyl)furan-3-yl]methanamine?
The IUPAC name of [2-methyl-5-(quinolin-7-yloxymethyl)furan-3-yl]methanamine (CID 107315020) is [2-methyl-5-(quinolin-7-yloxymethyl)furan-3-yl]methanamine.
What is the SMILES notation for [2-methyl-5-(quinolin-7-yloxymethyl)furan-3-yl]methanamine?
The canonical SMILES for [2-methyl-5-(quinolin-7-yloxymethyl)furan-3-yl]methanamine is Cc1oc(COc2ccc3cccnc3c2)cc1CN.
What is the InChIKey of [2-methyl-5-(quinolin-7-yloxymethyl)furan-3-yl]methanamine?
The InChIKey is WCXYIOITWWUQSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O2/c1-11-13(9-17)7-15(20-11)10-19-14-5-4-12-3-2-6-18-16(12)8-14/h2-8H,9-10,17H2,1H3.
What are the key properties of [2-methyl-5-(quinolin-7-yloxymethyl)furan-3-yl]methanamine?
[2-methyl-5-(quinolin-7-yloxymethyl)furan-3-yl]methanamine has a molecular weight of 268.32 g/mol, XLogP of 3.17, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-methyl-5-(quinolin-7-yloxymethyl)furan-3-yl]methanamine is sourced from PubChem (CID 107315020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).