[5-(2-methoxyphenoxy)furan-2-yl]methanamine

C12H13NO3 — CID 28815260

IUPAC[5-(2-methoxyphenoxy)furan-2-yl]methanamine
SMILESCOc1ccccc1Oc1ccc(CN)o1
InChIInChI=1S/C12H13NO3/c1-14-10-4-2-3-5-11(10)16-12-7-6-9(8-13)15-12/h2-7H,8,13H2,1H3
InChIKeyJLJKERUQCBWCAR-UHFFFAOYSA-N
MW219.24 g/mol
LogP2.54
Rot. Bonds4

About [5-(2-methoxyphenoxy)furan-2-yl]methanamine

[5-(2-methoxyphenoxy)furan-2-yl]methanamine (PubChem CID 28815260) has the molecular formula C12H13NO3 and a molecular weight of 219.24 g/mol. Its IUPAC name is [5-(2-methoxyphenoxy)furan-2-yl]methanamine.

Molecular Properties

Compound Name[5-(2-methoxyphenoxy)furan-2-yl]methanamine
PubChem CID28815260
Molecular FormulaC12H13NO3
Molecular Weight219.24 g/mol
Exact Mass219.09
IUPAC Name[5-(2-methoxyphenoxy)furan-2-yl]methanamine
SMILESCOc1ccccc1Oc1ccc(CN)o1
InChIInChI=1S/C12H13NO3/c1-14-10-4-2-3-5-11(10)16-12-7-6-9(8-13)15-12/h2-7H,8,13H2,1H3
InChIKeyJLJKERUQCBWCAR-UHFFFAOYSA-N
XLogP2.54
TPSA57.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.24
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(5-naphthalen-1-yloxyfuran-2-yl)methanamine;hydrochloride
CID 82021899
[5-[(2-methoxyphenoxy)methyl]furan-2-yl]methanamine
CID 55077285
(5-phenoxyfuran-2-yl)methanamine;hydrochloride
CID 82021880
[5-[(2,6-dimethoxyphenoxy)methyl]furan-2-yl]methanamine
CID 62451638
azane;1,2-dimethoxybenzene
CID 174437926
1,2-dimethoxybenzene;dihydrochloride
CID 19834650
[2-(2-methoxyphenoxy)-4-methylphenyl]methanamine
CID 62306948
[2-(2,6-dimethoxyphenyl)-1,3-oxazol-5-yl]methanamine
CID 82083022
[5-(2,3,4-trimethoxyphenyl)furan-2-yl]methanamine
CID 106888714
2-[4-(2-methoxyphenoxy)phenyl]ethanamine
CID 20986924
[5-(2,5-dimethoxyphenyl)furan-2-yl]methanamine
CID 106887065
[5-[(2-propan-2-ylphenoxy)methyl]furan-2-yl]methanamine
CID 62458746

Frequently Asked Questions

What is the IUPAC name of [5-(2-methoxyphenoxy)furan-2-yl]methanamine?
The IUPAC name of [5-(2-methoxyphenoxy)furan-2-yl]methanamine (CID 28815260) is [5-(2-methoxyphenoxy)furan-2-yl]methanamine.
What is the SMILES notation for [5-(2-methoxyphenoxy)furan-2-yl]methanamine?
The canonical SMILES for [5-(2-methoxyphenoxy)furan-2-yl]methanamine is COc1ccccc1Oc1ccc(CN)o1.
What is the InChIKey of [5-(2-methoxyphenoxy)furan-2-yl]methanamine?
The InChIKey is JLJKERUQCBWCAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NO3/c1-14-10-4-2-3-5-11(10)16-12-7-6-9(8-13)15-12/h2-7H,8,13H2,1H3.
What are the key properties of [5-(2-methoxyphenoxy)furan-2-yl]methanamine?
[5-(2-methoxyphenoxy)furan-2-yl]methanamine has a molecular weight of 219.24 g/mol, XLogP of 2.54, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(2-methoxyphenoxy)furan-2-yl]methanamine is sourced from PubChem (CID 28815260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).