[4-(furan-2-yl)-2,6-dimethoxyphenyl]methanamine

C13H15NO3 — CID 150177853

IUPAC[4-(furan-2-yl)-2,6-dimethoxyphenyl]methanamine
SMILESCOc1cc(-c2ccco2)cc(OC)c1CN
InChIInChI=1S/C13H15NO3/c1-15-12-6-9(11-4-3-5-17-11)7-13(16-2)10(12)8-14/h3-7H,8,14H2,1-2H3
InChIKeyFKUDLILTCDRDLT-UHFFFAOYSA-N
MW233.27 g/mol
LogP2.42
Rot. Bonds4

About [4-(furan-2-yl)-2,6-dimethoxyphenyl]methanamine

[4-(furan-2-yl)-2,6-dimethoxyphenyl]methanamine (PubChem CID 150177853) has the molecular formula C13H15NO3 and a molecular weight of 233.27 g/mol. Its IUPAC name is [4-(furan-2-yl)-2,6-dimethoxyphenyl]methanamine.

Molecular Properties

Compound Name[4-(furan-2-yl)-2,6-dimethoxyphenyl]methanamine
PubChem CID150177853
Molecular FormulaC13H15NO3
Molecular Weight233.27 g/mol
Exact Mass233.11
IUPAC Name[4-(furan-2-yl)-2,6-dimethoxyphenyl]methanamine
SMILESCOc1cc(-c2ccco2)cc(OC)c1CN
InChIInChI=1S/C13H15NO3/c1-15-12-6-9(11-4-3-5-17-11)7-13(16-2)10(12)8-14/h3-7H,8,14H2,1-2H3
InChIKeyFKUDLILTCDRDLT-UHFFFAOYSA-N
XLogP2.42
TPSA57.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.27
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(furan-2-yl)-2-methoxy-6-(methylideneamino)phenol
CID 173106037
4-(furan-2-yl)-2-methoxybenzoic acid
CID 53224787
[4-(furan-2-yl)-2,6-dimethoxyphenyl] benzoate
CID 58431996
2-[4-(furan-2-yl)-2-methoxyphenoxy]acetamide
CID 168526436
2-[4-methoxy-3-(trifluoromethoxy)phenyl]furan
CID 168525465
N-[4-(furan-2-yl)-2-methoxyphenyl]-2-methoxyacetamide
CID 168524887
(2,6-dimethoxy-4-methylphenyl)methanamine
CID 58024962
4-(furan-2-yl)-6-(3,4,5-trimethoxyphenyl)pyrimidin-2-amine
CID 75360227
3-(furan-2-yl)-5-methoxypyridine
CID 174589333
ethane;2-phenylfuran
CID 143157762
4-[4-(furan-2-yl)-2-methoxyphenyl]morpholine
CID 168525030
1-[5-[4-(furan-2-yl)-2-methoxyphenyl]furan-2-yl]ethanone
CID 168527546

Frequently Asked Questions

What is the IUPAC name of [4-(furan-2-yl)-2,6-dimethoxyphenyl]methanamine?
The IUPAC name of [4-(furan-2-yl)-2,6-dimethoxyphenyl]methanamine (CID 150177853) is [4-(furan-2-yl)-2,6-dimethoxyphenyl]methanamine.
What is the SMILES notation for [4-(furan-2-yl)-2,6-dimethoxyphenyl]methanamine?
The canonical SMILES for [4-(furan-2-yl)-2,6-dimethoxyphenyl]methanamine is COc1cc(-c2ccco2)cc(OC)c1CN.
What is the InChIKey of [4-(furan-2-yl)-2,6-dimethoxyphenyl]methanamine?
The InChIKey is FKUDLILTCDRDLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO3/c1-15-12-6-9(11-4-3-5-17-11)7-13(16-2)10(12)8-14/h3-7H,8,14H2,1-2H3.
What are the key properties of [4-(furan-2-yl)-2,6-dimethoxyphenyl]methanamine?
[4-(furan-2-yl)-2,6-dimethoxyphenyl]methanamine has a molecular weight of 233.27 g/mol, XLogP of 2.42, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(furan-2-yl)-2,6-dimethoxyphenyl]methanamine is sourced from PubChem (CID 150177853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).