(R)-(4-ethoxyphenyl)-thiophen-3-ylmethanamine

C13H15NOS — CID 93053796

IUPAC(R)-(4-ethoxyphenyl)-thiophen-3-ylmethanamine
SMILESCCOc1ccc([C@@H](N)c2ccsc2)cc1
InChIInChI=1S/C13H15NOS/c1-2-15-12-5-3-10(4-6-12)13(14)11-7-8-16-9-11/h3-9,13H,2,14H2,1H3/t13-/m1/s1
InChIKeyCXIFDZZTLFBDIA-CYBMUJFWSA-N
MW233.34 g/mol
LogP3.19
Rot. Bonds4

About (R)-(4-ethoxyphenyl)-thiophen-3-ylmethanamine

(R)-(4-ethoxyphenyl)-thiophen-3-ylmethanamine (PubChem CID 93053796) has the molecular formula C13H15NOS and a molecular weight of 233.34 g/mol. Its IUPAC name is (R)-(4-ethoxyphenyl)-thiophen-3-ylmethanamine.

Molecular Properties

Compound Name(R)-(4-ethoxyphenyl)-thiophen-3-ylmethanamine
PubChem CID93053796
Molecular FormulaC13H15NOS
Molecular Weight233.34 g/mol
Exact Mass233.09
IUPAC Name(R)-(4-ethoxyphenyl)-thiophen-3-ylmethanamine
SMILESCCOc1ccc([C@@H](N)c2ccsc2)cc1
InChIInChI=1S/C13H15NOS/c1-2-15-12-5-3-10(4-6-12)13(14)11-7-8-16-9-11/h3-9,13H,2,14H2,1H3/t13-/m1/s1
InChIKeyCXIFDZZTLFBDIA-CYBMUJFWSA-N
XLogP3.19
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.34
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4-ethoxyphenyl)-thiophen-3-ylmethyl]ethanamine
CID 43489387
(S)-(4-ethylphenyl)-thiophen-3-ylmethanamine
CID 171211233
(S)-(4-ethoxy-3-methoxyphenyl)-thiophen-3-ylmethanamine
CID 171212249
(4-ethoxyphenyl)-(4-ethylsulfanylphenyl)methanamine
CID 106848489
(R)-[4-(difluoromethoxy)phenyl]-thiophen-3-ylmethanamine
CID 171225773
(R)-(4-phenoxyphenyl)-thiophen-3-ylmethanamine;hydrochloride
CID 171228385
[4-[(R)-amino(thiophen-3-yl)methyl]phenyl] acetate;hydrochloride
CID 171229424
(R)-(4-ethoxyphenyl)-[4-(trifluoromethoxy)phenyl]methanamine
CID 171239826
(4-fluorophenyl)-thiophen-3-ylmethanamine
CID 43463924
(5-bromo-2-ethoxyphenyl)-thiophen-3-ylmethanamine
CID 43464834
(R)-(6-methoxynaphthalen-2-yl)-thiophen-3-ylmethanamine;hydrochloride
CID 171218929
(4-ethoxyphenyl)-(1H-pyrazol-4-yl)methanamine
CID 82239705

Frequently Asked Questions

What is the IUPAC name of (R)-(4-ethoxyphenyl)-thiophen-3-ylmethanamine?
The IUPAC name of (R)-(4-ethoxyphenyl)-thiophen-3-ylmethanamine (CID 93053796) is (R)-(4-ethoxyphenyl)-thiophen-3-ylmethanamine.
What is the SMILES notation for (R)-(4-ethoxyphenyl)-thiophen-3-ylmethanamine?
The canonical SMILES for (R)-(4-ethoxyphenyl)-thiophen-3-ylmethanamine is CCOc1ccc([C@@H](N)c2ccsc2)cc1.
What is the InChIKey of (R)-(4-ethoxyphenyl)-thiophen-3-ylmethanamine?
The InChIKey is CXIFDZZTLFBDIA-CYBMUJFWSA-N. The full InChI is InChI=1S/C13H15NOS/c1-2-15-12-5-3-10(4-6-12)13(14)11-7-8-16-9-11/h3-9,13H,2,14H2,1H3/t13-/m1/s1.
What are the key properties of (R)-(4-ethoxyphenyl)-thiophen-3-ylmethanamine?
(R)-(4-ethoxyphenyl)-thiophen-3-ylmethanamine has a molecular weight of 233.34 g/mol, XLogP of 3.19, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-(4-ethoxyphenyl)-thiophen-3-ylmethanamine is sourced from PubChem (CID 93053796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).