2-(furan-2-yl)-1-(2-methoxy-5-methylphenyl)ethanamine

C14H17NO2 — CID 105029210

IUPAC2-(furan-2-yl)-1-(2-methoxy-5-methylphenyl)ethanamine
SMILESCOc1ccc(C)cc1C(N)Cc1ccco1
InChIInChI=1S/C14H17NO2/c1-10-5-6-14(16-2)12(8-10)13(15)9-11-4-3-7-17-11/h3-8,13H,9,15H2,1-2H3
InChIKeyPTFTYFORHZLLBB-UHFFFAOYSA-N
MW231.30 g/mol
LogP2.84
Rot. Bonds4

About 2-(furan-2-yl)-1-(2-methoxy-5-methylphenyl)ethanamine

2-(furan-2-yl)-1-(2-methoxy-5-methylphenyl)ethanamine (PubChem CID 105029210) has the molecular formula C14H17NO2 and a molecular weight of 231.30 g/mol. Its IUPAC name is 2-(furan-2-yl)-1-(2-methoxy-5-methylphenyl)ethanamine.

Molecular Properties

Compound Name2-(furan-2-yl)-1-(2-methoxy-5-methylphenyl)ethanamine
PubChem CID105029210
Molecular FormulaC14H17NO2
Molecular Weight231.30 g/mol
Exact Mass231.13
IUPAC Name2-(furan-2-yl)-1-(2-methoxy-5-methylphenyl)ethanamine
SMILESCOc1ccc(C)cc1C(N)Cc1ccco1
InChIInChI=1S/C14H17NO2/c1-10-5-6-14(16-2)12(8-10)13(15)9-11-4-3-7-17-11/h3-8,13H,9,15H2,1-2H3
InChIKeyPTFTYFORHZLLBB-UHFFFAOYSA-N
XLogP2.84
TPSA48.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(furan-2-yl)-1-(2-methoxy-4-methylphenyl)ethanamine
CID 106791252
(2S)-2-amino-2-(2-methoxy-5-methylphenyl)ethanol
CID 55278412
(1R)-1-(2-methoxy-5-methylphenyl)butan-1-amine
CID 55278250
1-(2-fluoro-3-methylphenyl)-2-(furan-2-yl)ethanamine
CID 105029224
1-(2,5-dimethylfuran-3-yl)-2-(furan-2-yl)ethanamine
CID 105029404
1-(2-methoxy-5-methylphenyl)-2-(4-propan-2-ylphenyl)ethanamine
CID 115844158
2-(2,5-dimethoxyphenyl)-3-(furan-2-yl)propan-1-amine
CID 112509189
1-(2-bromo-3-methylphenyl)-2-(furan-2-yl)ethanamine
CID 107985336
1-(2-methoxy-5-methylphenyl)-2-(2-methoxyphenoxy)ethanamine
CID 16785142
1-(3,4-diethoxyphenyl)-2-(furan-2-yl)ethanamine
CID 105029319
2-(4-fluoro-2-methylphenyl)-1-(2-methoxy-5-methylphenyl)ethanamine
CID 105050993
2-(3,4-dichlorophenyl)-1-(2-methoxy-5-methylphenyl)ethanamine
CID 62795612

Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-1-(2-methoxy-5-methylphenyl)ethanamine?
The IUPAC name of 2-(furan-2-yl)-1-(2-methoxy-5-methylphenyl)ethanamine (CID 105029210) is 2-(furan-2-yl)-1-(2-methoxy-5-methylphenyl)ethanamine.
What is the SMILES notation for 2-(furan-2-yl)-1-(2-methoxy-5-methylphenyl)ethanamine?
The canonical SMILES for 2-(furan-2-yl)-1-(2-methoxy-5-methylphenyl)ethanamine is COc1ccc(C)cc1C(N)Cc1ccco1.
What is the InChIKey of 2-(furan-2-yl)-1-(2-methoxy-5-methylphenyl)ethanamine?
The InChIKey is PTFTYFORHZLLBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO2/c1-10-5-6-14(16-2)12(8-10)13(15)9-11-4-3-7-17-11/h3-8,13H,9,15H2,1-2H3.
What are the key properties of 2-(furan-2-yl)-1-(2-methoxy-5-methylphenyl)ethanamine?
2-(furan-2-yl)-1-(2-methoxy-5-methylphenyl)ethanamine has a molecular weight of 231.30 g/mol, XLogP of 2.84, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-1-(2-methoxy-5-methylphenyl)ethanamine is sourced from PubChem (CID 105029210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).