2,3-dihydrofuran-5-yl-(4-ethylphenyl)methanamine

C13H17NO — CID 102651207

IUPAC2,3-dihydrofuran-5-yl-(4-ethylphenyl)methanamine
SMILESCCc1ccc(C(N)C2=CCCO2)cc1
InChIInChI=1S/C13H17NO/c1-2-10-5-7-11(8-6-10)13(14)12-4-3-9-15-12/h4-8,13H,2-3,9,14H2,1H3
InChIKeyITDSMNDARLNFKA-UHFFFAOYSA-N
MW203.28 g/mol
LogP2.55
Rot. Bonds3

About 2,3-dihydrofuran-5-yl-(4-ethylphenyl)methanamine

2,3-dihydrofuran-5-yl-(4-ethylphenyl)methanamine (PubChem CID 102651207) has the molecular formula C13H17NO and a molecular weight of 203.28 g/mol. Its IUPAC name is 2,3-dihydrofuran-5-yl-(4-ethylphenyl)methanamine.

Molecular Properties

Compound Name2,3-dihydrofuran-5-yl-(4-ethylphenyl)methanamine
PubChem CID102651207
Molecular FormulaC13H17NO
Molecular Weight203.28 g/mol
Exact Mass203.13
IUPAC Name2,3-dihydrofuran-5-yl-(4-ethylphenyl)methanamine
SMILESCCc1ccc(C(N)C2=CCCO2)cc1
InChIInChI=1S/C13H17NO/c1-2-10-5-7-11(8-6-10)13(14)12-4-3-9-15-12/h4-8,13H,2-3,9,14H2,1H3
InChIKeyITDSMNDARLNFKA-UHFFFAOYSA-N
XLogP2.55
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.28
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[(1E)-cycloocten-1-yl]-(4-ethylphenyl)methanamine
CID 106652462
1-(2,3-dihydrofuran-5-yl)pentan-1-amine
CID 102651898
1-(2,3-dihydrofuran-5-yl)-3-(4-methylphenyl)propan-1-amine
CID 102653299
(1,3-diethylpyrazol-5-yl)-(2,3-dihydrofuran-5-yl)methanamine
CID 102653075
(4-ethylphenyl)-[4-(2-methylpropyl)phenyl]methanamine
CID 43109928
2-(4-bromophenyl)-1-(2,3-dihydrofuran-5-yl)ethanamine
CID 102651201
(1R)-1-(4-ethylphenyl)ethanamine
CID 2063952
(4-ethylphenyl)-pyridazin-4-ylmethanamine
CID 105121539
chloro-(4-ethylphenyl)methanamine
CID 116947710
(3,4-difluorophenyl)-(3,4-dihydro-2H-pyran-6-yl)methanamine
CID 102647123
2,3-dihydrofuran-5-yl-(6-methoxypyridazin-3-yl)methanamine
CID 103373797
(4-ethylphenyl)-(5-methyl-1,3,4-oxadiazol-2-yl)methanamine
CID 82024267

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydrofuran-5-yl-(4-ethylphenyl)methanamine?
The IUPAC name of 2,3-dihydrofuran-5-yl-(4-ethylphenyl)methanamine (CID 102651207) is 2,3-dihydrofuran-5-yl-(4-ethylphenyl)methanamine.
What is the SMILES notation for 2,3-dihydrofuran-5-yl-(4-ethylphenyl)methanamine?
The canonical SMILES for 2,3-dihydrofuran-5-yl-(4-ethylphenyl)methanamine is CCc1ccc(C(N)C2=CCCO2)cc1.
What is the InChIKey of 2,3-dihydrofuran-5-yl-(4-ethylphenyl)methanamine?
The InChIKey is ITDSMNDARLNFKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO/c1-2-10-5-7-11(8-6-10)13(14)12-4-3-9-15-12/h4-8,13H,2-3,9,14H2,1H3.
What are the key properties of 2,3-dihydrofuran-5-yl-(4-ethylphenyl)methanamine?
2,3-dihydrofuran-5-yl-(4-ethylphenyl)methanamine has a molecular weight of 203.28 g/mol, XLogP of 2.55, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydrofuran-5-yl-(4-ethylphenyl)methanamine is sourced from PubChem (CID 102651207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).