[5-(3-methoxyphenyl)furan-2-yl]methanamine

C12H13NO2 — CID 43826373

IUPAC[5-(3-methoxyphenyl)furan-2-yl]methanamine
SMILESCOc1cccc(-c2ccc(CN)o2)c1
InChIInChI=1S/C12H13NO2/c1-14-10-4-2-3-9(7-10)12-6-5-11(8-13)15-12/h2-7H,8,13H2,1H3
InChIKeyYFWACUKHOIORSM-UHFFFAOYSA-N
MW203.24 g/mol
LogP2.41
Rot. Bonds3

About [5-(3-methoxyphenyl)furan-2-yl]methanamine

[5-(3-methoxyphenyl)furan-2-yl]methanamine (PubChem CID 43826373) has the molecular formula C12H13NO2 and a molecular weight of 203.24 g/mol. Its IUPAC name is [5-(3-methoxyphenyl)furan-2-yl]methanamine.

Molecular Properties

Compound Name[5-(3-methoxyphenyl)furan-2-yl]methanamine
PubChem CID43826373
Molecular FormulaC12H13NO2
Molecular Weight203.24 g/mol
Exact Mass203.09
IUPAC Name[5-(3-methoxyphenyl)furan-2-yl]methanamine
SMILESCOc1cccc(-c2ccc(CN)o2)c1
InChIInChI=1S/C12H13NO2/c1-14-10-4-2-3-9(7-10)12-6-5-11(8-13)15-12/h2-7H,8,13H2,1H3
InChIKeyYFWACUKHOIORSM-UHFFFAOYSA-N
XLogP2.41
TPSA48.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.24
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[5-(3-methoxyphenyl)furan-2-yl]methyl]ethanamine
CID 106886886
methyl 2-amino-3-[5-(3-methoxyphenyl)furan-2-yl]propanoate
CID 170884284
[5-(2,5-dimethoxyphenyl)furan-2-yl]methanamine
CID 106887065
[5-(3-methoxyphenyl)-1,2-oxazol-3-yl]methanamine;hydrochloride
CID 50998515
[4-(3-methoxyphenyl)phenyl]methanamine;hydrochloride
CID 71432523
[5-(aminomethyl)furan-2-yl]-(3-methoxyphenyl)methanone
CID 82082014
azane;1-methoxy-3-(3-methoxyphenyl)benzene
CID 174719266
1-methoxy-3-(3-methoxyphenyl)benzene;sulfane
CID 175169762
5-(3-methoxyphenyl)-2,3-dimethylfuran
CID 70996763
3-[5-(3-methoxyphenyl)-1,3-oxazol-2-yl]propan-1-amine
CID 65179138
5-(aminomethyl)-N-[(1R)-1-(3-methoxyphenyl)ethyl]furan-2-carboxamide
CID 81373778
5-(3-methoxyphenyl)-2-methyl-1,3-oxazole
CID 67394978

Frequently Asked Questions

What is the IUPAC name of [5-(3-methoxyphenyl)furan-2-yl]methanamine?
The IUPAC name of [5-(3-methoxyphenyl)furan-2-yl]methanamine (CID 43826373) is [5-(3-methoxyphenyl)furan-2-yl]methanamine.
What is the SMILES notation for [5-(3-methoxyphenyl)furan-2-yl]methanamine?
The canonical SMILES for [5-(3-methoxyphenyl)furan-2-yl]methanamine is COc1cccc(-c2ccc(CN)o2)c1.
What is the InChIKey of [5-(3-methoxyphenyl)furan-2-yl]methanamine?
The InChIKey is YFWACUKHOIORSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NO2/c1-14-10-4-2-3-9(7-10)12-6-5-11(8-13)15-12/h2-7H,8,13H2,1H3.
What are the key properties of [5-(3-methoxyphenyl)furan-2-yl]methanamine?
[5-(3-methoxyphenyl)furan-2-yl]methanamine has a molecular weight of 203.24 g/mol, XLogP of 2.41, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(3-methoxyphenyl)furan-2-yl]methanamine is sourced from PubChem (CID 43826373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).