(1R)-1-[1-(2-thiophen-2-ylethoxy)naphthalen-2-yl]ethanamine

C18H19NOS — CID 78950759

IUPAC(1R)-1-[1-(2-thiophen-2-ylethoxy)naphthalen-2-yl]ethanamine
SMILESC[C@@H](N)c1ccc2ccccc2c1OCCc1cccs1
InChIInChI=1S/C18H19NOS/c1-13(19)16-9-8-14-5-2-3-7-17(14)18(16)20-11-10-15-6-4-12-21-15/h2-9,12-13H,10-11,19H2,1H3/t13-/m1/s1
InChIKeySZUNWBNJYYJDBX-CYBMUJFWSA-N
MW297.42 g/mol
LogP4.54
Rot. Bonds5

About (1R)-1-[1-(2-thiophen-2-ylethoxy)naphthalen-2-yl]ethanamine

(1R)-1-[1-(2-thiophen-2-ylethoxy)naphthalen-2-yl]ethanamine (PubChem CID 78950759) has the molecular formula C18H19NOS and a molecular weight of 297.42 g/mol. Its IUPAC name is (1R)-1-[1-(2-thiophen-2-ylethoxy)naphthalen-2-yl]ethanamine.

Molecular Properties

Compound Name(1R)-1-[1-(2-thiophen-2-ylethoxy)naphthalen-2-yl]ethanamine
PubChem CID78950759
Molecular FormulaC18H19NOS
Molecular Weight297.42 g/mol
Exact Mass297.12
IUPAC Name(1R)-1-[1-(2-thiophen-2-ylethoxy)naphthalen-2-yl]ethanamine
SMILESC[C@@H](N)c1ccc2ccccc2c1OCCc1cccs1
InChIInChI=1S/C18H19NOS/c1-13(19)16-9-8-14-5-2-3-7-17(14)18(16)20-11-10-15-6-4-12-21-15/h2-9,12-13H,10-11,19H2,1H3/t13-/m1/s1
InChIKeySZUNWBNJYYJDBX-CYBMUJFWSA-N
XLogP4.54
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.42
LogP ≤ 54.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[1-(thiophen-2-ylmethoxy)naphthalen-2-yl]ethanamine
CID 60889983
1-[2-(2-thiophen-2-ylethoxy)phenyl]ethanamine
CID 54966969
(1S)-1-[1-(2-propan-2-yloxyethoxy)naphthalen-2-yl]ethanamine
CID 63368514
(1S)-1-[4-bromo-2-(2-thiophen-2-ylethoxy)phenyl]ethanamine
CID 102947209
(1S)-1-[1-[(4-bromothiophen-2-yl)methoxy]naphthalen-2-yl]ethanamine
CID 63368464
(1R)-1-[1-(1,3-thiazol-5-ylmethoxy)naphthalen-2-yl]ethanamine
CID 103953958
1-phenyl-1-(2-thiophen-2-ylethoxy)propan-2-amine
CID 55017191
1-(2-methylphenyl)-1-(2-thiophen-2-ylethoxy)propan-2-amine
CID 55018719
3-[2-[(1R)-1-aminoethyl]naphthalen-1-yl]oxy-N,N-dimethylpropanamide
CID 78930722
1-[2-[(1S)-1-aminoethyl]naphthalen-1-yl]oxy-3-methoxypropan-2-ol
CID 63928570
(1R)-1-[5-fluoro-2-(2-thiophen-2-ylethoxy)phenyl]ethanamine
CID 63370121
1-[5-chloro-2-(2-thiophen-2-ylethoxy)phenyl]ethanamine
CID 63775282

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[1-(2-thiophen-2-ylethoxy)naphthalen-2-yl]ethanamine?
The IUPAC name of (1R)-1-[1-(2-thiophen-2-ylethoxy)naphthalen-2-yl]ethanamine (CID 78950759) is (1R)-1-[1-(2-thiophen-2-ylethoxy)naphthalen-2-yl]ethanamine.
What is the SMILES notation for (1R)-1-[1-(2-thiophen-2-ylethoxy)naphthalen-2-yl]ethanamine?
The canonical SMILES for (1R)-1-[1-(2-thiophen-2-ylethoxy)naphthalen-2-yl]ethanamine is C[C@@H](N)c1ccc2ccccc2c1OCCc1cccs1.
What is the InChIKey of (1R)-1-[1-(2-thiophen-2-ylethoxy)naphthalen-2-yl]ethanamine?
The InChIKey is SZUNWBNJYYJDBX-CYBMUJFWSA-N. The full InChI is InChI=1S/C18H19NOS/c1-13(19)16-9-8-14-5-2-3-7-17(14)18(16)20-11-10-15-6-4-12-21-15/h2-9,12-13H,10-11,19H2,1H3/t13-/m1/s1.
What are the key properties of (1R)-1-[1-(2-thiophen-2-ylethoxy)naphthalen-2-yl]ethanamine?
(1R)-1-[1-(2-thiophen-2-ylethoxy)naphthalen-2-yl]ethanamine has a molecular weight of 297.42 g/mol, XLogP of 4.54, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[1-(2-thiophen-2-ylethoxy)naphthalen-2-yl]ethanamine is sourced from PubChem (CID 78950759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).