1-[1-(thiophen-2-ylmethoxy)naphthalen-2-yl]ethanamine

C17H17NOS — CID 60889983

IUPAC1-[1-(thiophen-2-ylmethoxy)naphthalen-2-yl]ethanamine
SMILESCC(N)c1ccc2ccccc2c1OCc1cccs1
InChIInChI=1S/C17H17NOS/c1-12(18)15-9-8-13-5-2-3-7-16(13)17(15)19-11-14-6-4-10-20-14/h2-10,12H,11,18H2,1H3
InChIKeyXBABMRFZCYTBTP-UHFFFAOYSA-N
MW283.40 g/mol
LogP4.50
Rot. Bonds4

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

1-[1-(thiophen-2-ylmethoxy)naphthalen-2-yl]ethanamine (PubChem CID 60889983) has the molecular formula C17H17NOS and a molecular weight of 283.40 g/mol. Its IUPAC name is 1-[1-(thiophen-2-ylmethoxy)naphthalen-2-yl]ethanamine.

Molecular Properties

Compound Name1-[1-(thiophen-2-ylmethoxy)naphthalen-2-yl]ethanamine
PubChem CID60889983
Molecular FormulaC17H17NOS
Molecular Weight283.40 g/mol
Exact Mass283.10
IUPAC Name1-[1-(thiophen-2-ylmethoxy)naphthalen-2-yl]ethanamine
SMILESCC(N)c1ccc2ccccc2c1OCc1cccs1
InChIInChI=1S/C17H17NOS/c1-12(18)15-9-8-13-5-2-3-7-16(13)17(15)19-11-14-6-4-10-20-14/h2-10,12H,11,18H2,1H3
InChIKeyXBABMRFZCYTBTP-UHFFFAOYSA-N
XLogP4.50
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.40
LogP ≤ 54.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1R)-1-[1-(2-thiophen-2-ylethoxy)naphthalen-2-yl]ethanamine
CID 78950759
(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
(1R)-1-[1-(cyclopropylmethoxy)naphthalen-2-yl]ethanamine
CID 78937490
(1R)-1-[4-bromo-2-(thiophen-2-ylmethoxy)phenyl]ethanamine
CID 102946837
(1R)-1-[1-[(3-methyl-1,2-oxazol-5-yl)methoxy]naphthalen-2-yl]ethanamine
CID 63368469
(1S)-1-[1-(2-propan-2-yloxyethoxy)naphthalen-2-yl]ethanamine
CID 63368514
(1S)-1-[1-(2-ethylsulfonylethoxy)naphthalen-2-yl]ethanamine
CID 63368402
1-[1-(pyridin-3-ylmethoxy)naphthalen-2-yl]ethanamine
CID 43475190
3-[2-[(1R)-1-aminoethyl]naphthalen-1-yl]oxy-2-methylpropan-1-ol
CID 104881475
(1R)-1-[1-[(2-methyl-1,2,4-triazol-3-yl)methoxy]naphthalen-2-yl]ethanamine
CID 79013841
(1R)-1-(1-but-3-enoxynaphthalen-2-yl)ethanamine
CID 78967478

Frequently Asked Questions

What is the IUPAC name of 1-[1-(thiophen-2-ylmethoxy)naphthalen-2-yl]ethanamine?
The IUPAC name of 1-[1-(thiophen-2-ylmethoxy)naphthalen-2-yl]ethanamine (CID 60889983) is 1-[1-(thiophen-2-ylmethoxy)naphthalen-2-yl]ethanamine.
What is the SMILES notation for 1-[1-(thiophen-2-ylmethoxy)naphthalen-2-yl]ethanamine?
The canonical SMILES for 1-[1-(thiophen-2-ylmethoxy)naphthalen-2-yl]ethanamine is CC(N)c1ccc2ccccc2c1OCc1cccs1.
What is the InChIKey of 1-[1-(thiophen-2-ylmethoxy)naphthalen-2-yl]ethanamine?
The InChIKey is XBABMRFZCYTBTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NOS/c1-12(18)15-9-8-13-5-2-3-7-16(13)17(15)19-11-14-6-4-10-20-14/h2-10,12H,11,18H2,1H3.
What are the key properties of 1-[1-(thiophen-2-ylmethoxy)naphthalen-2-yl]ethanamine?
1-[1-(thiophen-2-ylmethoxy)naphthalen-2-yl]ethanamine has a molecular weight of 283.40 g/mol, XLogP of 4.50, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(thiophen-2-ylmethoxy)naphthalen-2-yl]ethanamine is sourced from PubChem (CID 60889983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).