(2-ethylfuran-3-yl)-(4-methoxyphenyl)methanamine

C14H17NO2 — CID 114102970

IUPAC(2-ethylfuran-3-yl)-(4-methoxyphenyl)methanamine
SMILESCCc1occc1C(N)c1ccc(OC)cc1
InChIInChI=1S/C14H17NO2/c1-3-13-12(8-9-17-13)14(15)10-4-6-11(16-2)7-5-10/h4-9,14H,3,15H2,1-2H3
InChIKeyKBIWWOHOKYPAPX-UHFFFAOYSA-N
MW231.30 g/mol
LogP2.90
Rot. Bonds4

About (2-ethylfuran-3-yl)-(4-methoxyphenyl)methanamine

(2-ethylfuran-3-yl)-(4-methoxyphenyl)methanamine (PubChem CID 114102970) has the molecular formula C14H17NO2 and a molecular weight of 231.30 g/mol. Its IUPAC name is (2-ethylfuran-3-yl)-(4-methoxyphenyl)methanamine.

Molecular Properties

Compound Name(2-ethylfuran-3-yl)-(4-methoxyphenyl)methanamine
PubChem CID114102970
Molecular FormulaC14H17NO2
Molecular Weight231.30 g/mol
Exact Mass231.13
IUPAC Name(2-ethylfuran-3-yl)-(4-methoxyphenyl)methanamine
SMILESCCc1occc1C(N)c1ccc(OC)cc1
InChIInChI=1S/C14H17NO2/c1-3-13-12(8-9-17-13)14(15)10-4-6-11(16-2)7-5-10/h4-9,14H,3,15H2,1-2H3
InChIKeyKBIWWOHOKYPAPX-UHFFFAOYSA-N
XLogP2.90
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 ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(5-ethoxy-3-pyridinyl)-(2-ethylfuran-3-yl)methanamine
CID 114104489
(2-bromofuran-3-yl)-(6-methoxynaphthalen-2-yl)methanamine
CID 106851764
(4-methoxyphenyl)-(2-methylphenyl)methanamine
CID 24688459
[2-(2-methoxyethoxy)phenyl]-(4-methoxyphenyl)methanamine
CID 104659745
(4-butan-2-ylphenyl)-(4-methoxyphenyl)methanamine
CID 43198098
(3,4-diethylphenyl)-(4-methoxyphenyl)methanamine
CID 115481951
(4-methoxyphenyl)-(4-propoxyphenyl)methanamine
CID 62796455
(2,5-dimethoxyphenyl)-(4-methoxyphenyl)methanamine
CID 43197203
2-amino-2-(2-ethylfuran-3-yl)acetic acid
CID 55295015
(4-methoxyphenyl)-[2-(methylaminomethyl)phenyl]methanamine
CID 14978247
3-amino-1-(2-bromofuran-3-yl)-2-(4-methoxyphenyl)propan-1-ol
CID 106856327
(5-fluoro-2-methoxyphenyl)-(4-methoxyphenyl)methanamine
CID 43122364

Frequently Asked Questions

What is the IUPAC name of (2-ethylfuran-3-yl)-(4-methoxyphenyl)methanamine?
The IUPAC name of (2-ethylfuran-3-yl)-(4-methoxyphenyl)methanamine (CID 114102970) is (2-ethylfuran-3-yl)-(4-methoxyphenyl)methanamine.
What is the SMILES notation for (2-ethylfuran-3-yl)-(4-methoxyphenyl)methanamine?
The canonical SMILES for (2-ethylfuran-3-yl)-(4-methoxyphenyl)methanamine is CCc1occc1C(N)c1ccc(OC)cc1.
What is the InChIKey of (2-ethylfuran-3-yl)-(4-methoxyphenyl)methanamine?
The InChIKey is KBIWWOHOKYPAPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO2/c1-3-13-12(8-9-17-13)14(15)10-4-6-11(16-2)7-5-10/h4-9,14H,3,15H2,1-2H3.
What are the key properties of (2-ethylfuran-3-yl)-(4-methoxyphenyl)methanamine?
(2-ethylfuran-3-yl)-(4-methoxyphenyl)methanamine has a molecular weight of 231.30 g/mol, XLogP of 2.90, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethylfuran-3-yl)-(4-methoxyphenyl)methanamine is sourced from PubChem (CID 114102970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).