[5-[(2-propan-2-ylphenoxy)methyl]furan-2-yl]methanamine

C15H19NO2 — CID 62458746

IUPAC[5-[(2-propan-2-ylphenoxy)methyl]furan-2-yl]methanamine
SMILESCC(C)c1ccccc1OCc1ccc(CN)o1
InChIInChI=1S/C15H19NO2/c1-11(2)14-5-3-4-6-15(14)17-10-13-8-7-12(9-16)18-13/h3-8,11H,9-10,16H2,1-2H3
InChIKeyIKCSMWUYSNBXCY-UHFFFAOYSA-N
MW245.32 g/mol
LogP3.44
Rot. Bonds5

About [5-[(2-propan-2-ylphenoxy)methyl]furan-2-yl]methanamine

[5-[(2-propan-2-ylphenoxy)methyl]furan-2-yl]methanamine (PubChem CID 62458746) has the molecular formula C15H19NO2 and a molecular weight of 245.32 g/mol. Its IUPAC name is [5-[(2-propan-2-ylphenoxy)methyl]furan-2-yl]methanamine.

Molecular Properties

Compound Name[5-[(2-propan-2-ylphenoxy)methyl]furan-2-yl]methanamine
PubChem CID62458746
Molecular FormulaC15H19NO2
Molecular Weight245.32 g/mol
Exact Mass245.14
IUPAC Name[5-[(2-propan-2-ylphenoxy)methyl]furan-2-yl]methanamine
SMILESCC(C)c1ccccc1OCc1ccc(CN)o1
InChIInChI=1S/C15H19NO2/c1-11(2)14-5-3-4-6-15(14)17-10-13-8-7-12(9-16)18-13/h3-8,11H,9-10,16H2,1-2H3
InChIKeyIKCSMWUYSNBXCY-UHFFFAOYSA-N
XLogP3.44
TPSA48.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[5-[(4-bromo-2-propan-2-ylphenoxy)methyl]furan-2-yl]methanamine
CID 115402732
[5-[(2-methoxyphenoxy)methyl]furan-2-yl]methanamine
CID 55077285
[5-[(2,3-dimethylphenoxy)methyl]furan-2-yl]methanamine
CID 62455058
[5-[(3-methyl-4-propan-2-ylphenoxy)methyl]furan-2-yl]methanamine
CID 62454908
(2R)-1-(2-propan-2-ylphenoxy)propan-2-amine
CID 30814005
N-[[5-[(2-propan-2-ylphenoxy)methyl]-1,2-oxazol-3-yl]methyl]cyclopropanamine
CID 62459429
[3-bromo-4-[(2-propan-2-ylphenoxy)methyl]phenyl]methanamine
CID 102773232
4-[(2-propan-2-ylphenoxy)methyl]-1,3-thiazole
CID 64764025
1-(2-methylpropoxy)-2-propan-2-ylbenzene
CID 58901647
1-iodo-4-[(2-propan-2-ylphenoxy)methyl]benzene
CID 65491120
[4-[2-(2-propan-2-ylphenoxy)ethoxy]phenyl]methanamine
CID 20989440
2-methyl-6-[(2-propan-2-ylphenoxy)methyl]pyridine
CID 79260812

Frequently Asked Questions

What is the IUPAC name of [5-[(2-propan-2-ylphenoxy)methyl]furan-2-yl]methanamine?
The IUPAC name of [5-[(2-propan-2-ylphenoxy)methyl]furan-2-yl]methanamine (CID 62458746) is [5-[(2-propan-2-ylphenoxy)methyl]furan-2-yl]methanamine.
What is the SMILES notation for [5-[(2-propan-2-ylphenoxy)methyl]furan-2-yl]methanamine?
The canonical SMILES for [5-[(2-propan-2-ylphenoxy)methyl]furan-2-yl]methanamine is CC(C)c1ccccc1OCc1ccc(CN)o1.
What is the InChIKey of [5-[(2-propan-2-ylphenoxy)methyl]furan-2-yl]methanamine?
The InChIKey is IKCSMWUYSNBXCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO2/c1-11(2)14-5-3-4-6-15(14)17-10-13-8-7-12(9-16)18-13/h3-8,11H,9-10,16H2,1-2H3.
What are the key properties of [5-[(2-propan-2-ylphenoxy)methyl]furan-2-yl]methanamine?
[5-[(2-propan-2-ylphenoxy)methyl]furan-2-yl]methanamine has a molecular weight of 245.32 g/mol, XLogP of 3.44, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[(2-propan-2-ylphenoxy)methyl]furan-2-yl]methanamine is sourced from PubChem (CID 62458746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).