2,3-dihydrofuran-5-yl-(3-propoxyphenyl)methanamine

C14H19NO2 — CID 102653139

IUPAC2,3-dihydrofuran-5-yl-(3-propoxyphenyl)methanamine
SMILESCCCOc1cccc(C(N)C2=CCCO2)c1
InChIInChI=1S/C14H19NO2/c1-2-8-16-12-6-3-5-11(10-12)14(15)13-7-4-9-17-13/h3,5-7,10,14H,2,4,8-9,15H2,1H3
InChIKeyBJEIOGPZQCNFGM-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.78
Rot. Bonds5

About 2,3-dihydrofuran-5-yl-(3-propoxyphenyl)methanamine

2,3-dihydrofuran-5-yl-(3-propoxyphenyl)methanamine (PubChem CID 102653139) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is 2,3-dihydrofuran-5-yl-(3-propoxyphenyl)methanamine.

Molecular Properties

Compound Name2,3-dihydrofuran-5-yl-(3-propoxyphenyl)methanamine
PubChem CID102653139
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC Name2,3-dihydrofuran-5-yl-(3-propoxyphenyl)methanamine
SMILESCCCOc1cccc(C(N)C2=CCCO2)c1
InChIInChI=1S/C14H19NO2/c1-2-8-16-12-6-3-5-11(10-12)14(15)13-7-4-9-17-13/h3,5-7,10,14H,2,4,8-9,15H2,1H3
InChIKeyBJEIOGPZQCNFGM-UHFFFAOYSA-N
XLogP2.78
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3-propoxyphenyl)-(3-propylphenyl)methanamine
CID 105050359
(2,5-dimethylfuran-3-yl)-(3-propoxyphenyl)methanamine
CID 62919680
(3,4-difluorophenyl)-(3-propoxyphenyl)methanamine
CID 62920523
(1R)-1-(3-propoxyphenyl)ethane-1,2-diamine
CID 66516554
(2,3-difluorophenyl)-(3-propoxyphenyl)methanamine
CID 115861923
(5-chlorothiophen-2-yl)-(3-propoxyphenyl)methanamine
CID 62921378
(3-propoxyphenyl)-(1,3-thiazol-2-yl)methanamine
CID 62499480
(4-bromo-5-chlorothiophen-2-yl)-(3-propoxyphenyl)methanamine
CID 102828054
[3,4-dihydro-2H-pyran-6-yl-(3-ethoxyphenyl)methyl]hydrazine
CID 102649871
(5-fluoro-3-pyridinyl)-(3-propoxyphenyl)methanamine
CID 115804729
1-(3-propoxyphenyl)pentan-1-ol
CID 65145757
2-methoxy-2-(3-propoxyphenyl)ethanamine
CID 66072172

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydrofuran-5-yl-(3-propoxyphenyl)methanamine?
The IUPAC name of 2,3-dihydrofuran-5-yl-(3-propoxyphenyl)methanamine (CID 102653139) is 2,3-dihydrofuran-5-yl-(3-propoxyphenyl)methanamine.
What is the SMILES notation for 2,3-dihydrofuran-5-yl-(3-propoxyphenyl)methanamine?
The canonical SMILES for 2,3-dihydrofuran-5-yl-(3-propoxyphenyl)methanamine is CCCOc1cccc(C(N)C2=CCCO2)c1.
What is the InChIKey of 2,3-dihydrofuran-5-yl-(3-propoxyphenyl)methanamine?
The InChIKey is BJEIOGPZQCNFGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO2/c1-2-8-16-12-6-3-5-11(10-12)14(15)13-7-4-9-17-13/h3,5-7,10,14H,2,4,8-9,15H2,1H3.
What are the key properties of 2,3-dihydrofuran-5-yl-(3-propoxyphenyl)methanamine?
2,3-dihydrofuran-5-yl-(3-propoxyphenyl)methanamine has a molecular weight of 233.31 g/mol, XLogP of 2.78, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydrofuran-5-yl-(3-propoxyphenyl)methanamine is sourced from PubChem (CID 102653139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).