[5-(furan-2-ylmethoxymethyl)-2-methoxyphenyl]methanamine

C14H17NO3 — CID 65338776

IUPAC[5-(furan-2-ylmethoxymethyl)-2-methoxyphenyl]methanamine
SMILESCOc1ccc(COCc2ccco2)cc1CN
InChIInChI=1S/C14H17NO3/c1-16-14-5-4-11(7-12(14)8-15)9-17-10-13-3-2-6-18-13/h2-7H,8-10,15H2,1H3
InChIKeyWYBTYCZTACQXBA-UHFFFAOYSA-N
MW247.29 g/mol
LogP2.46
Rot. Bonds6

About [5-(furan-2-ylmethoxymethyl)-2-methoxyphenyl]methanamine

[5-(furan-2-ylmethoxymethyl)-2-methoxyphenyl]methanamine (PubChem CID 65338776) has the molecular formula C14H17NO3 and a molecular weight of 247.29 g/mol. Its IUPAC name is [5-(furan-2-ylmethoxymethyl)-2-methoxyphenyl]methanamine.

Molecular Properties

Compound Name[5-(furan-2-ylmethoxymethyl)-2-methoxyphenyl]methanamine
PubChem CID65338776
Molecular FormulaC14H17NO3
Molecular Weight247.29 g/mol
Exact Mass247.12
IUPAC Name[5-(furan-2-ylmethoxymethyl)-2-methoxyphenyl]methanamine
SMILESCOc1ccc(COCc2ccco2)cc1CN
InChIInChI=1S/C14H17NO3/c1-16-14-5-4-11(7-12(14)8-15)9-17-10-13-3-2-6-18-13/h2-7H,8-10,15H2,1H3
InChIKeyWYBTYCZTACQXBA-UHFFFAOYSA-N
XLogP2.46
TPSA57.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.29
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(furan-2-ylmethoxymethyl)-N'-hydroxy-2-methoxybenzenecarboximidamide
CID 77066161
[5-[(2-bromophenyl)methoxymethyl]-2-methoxyphenyl]methanamine
CID 82827758
[2-methoxy-5-[3-(2-methoxyethoxy)propoxymethyl]phenyl]methanamine
CID 103401488
[4-(furan-2-ylmethoxy)-3-methylphenyl]methanamine
CID 60929324
2-[(3,4-dimethoxyphenyl)methyl]furan
CID 71735507
[5-(2-cyclobutylethoxymethyl)-2-methoxyphenyl]methanamine
CID 114157330
3-fluoro-N-[3-(furan-2-ylmethoxymethyl)phenyl]-4-methoxybenzamide
CID 87006764
[2-methoxy-5-(3-pyridin-4-ylpropoxymethyl)phenyl]methanamine
CID 65338927
[5-(1,1,1,3,3,3-hexafluoropropan-2-yloxymethyl)-2-methoxyphenyl]methanamine
CID 102721800
3-[4-(furan-2-ylmethoxymethyl)phenyl]prop-2-yn-1-amine
CID 54969860
[2-methoxy-5-[(2,4,5-trichlorophenoxy)methyl]phenyl]methanamine
CID 65338310
ethane;2-(methoxymethyl)furan
CID 143640700

Frequently Asked Questions

What is the IUPAC name of [5-(furan-2-ylmethoxymethyl)-2-methoxyphenyl]methanamine?
The IUPAC name of [5-(furan-2-ylmethoxymethyl)-2-methoxyphenyl]methanamine (CID 65338776) is [5-(furan-2-ylmethoxymethyl)-2-methoxyphenyl]methanamine.
What is the SMILES notation for [5-(furan-2-ylmethoxymethyl)-2-methoxyphenyl]methanamine?
The canonical SMILES for [5-(furan-2-ylmethoxymethyl)-2-methoxyphenyl]methanamine is COc1ccc(COCc2ccco2)cc1CN.
What is the InChIKey of [5-(furan-2-ylmethoxymethyl)-2-methoxyphenyl]methanamine?
The InChIKey is WYBTYCZTACQXBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO3/c1-16-14-5-4-11(7-12(14)8-15)9-17-10-13-3-2-6-18-13/h2-7H,8-10,15H2,1H3.
What are the key properties of [5-(furan-2-ylmethoxymethyl)-2-methoxyphenyl]methanamine?
[5-(furan-2-ylmethoxymethyl)-2-methoxyphenyl]methanamine has a molecular weight of 247.29 g/mol, XLogP of 2.46, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(furan-2-ylmethoxymethyl)-2-methoxyphenyl]methanamine is sourced from PubChem (CID 65338776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).