(2-methoxyphenyl)-thiophen-2-ylmethanamine

C12H13NOS — CID 43186740

IUPAC(2-methoxyphenyl)-thiophen-2-ylmethanamine
SMILESCOc1ccccc1C(N)c1cccs1
InChIInChI=1S/C12H13NOS/c1-14-10-6-3-2-5-9(10)12(13)11-7-4-8-15-11/h2-8,12H,13H2,1H3
InChIKeyBZTYQIJZTUNAKS-UHFFFAOYSA-N
MW219.31 g/mol
LogP2.80
Rot. Bonds3

About (2-methoxyphenyl)-thiophen-2-ylmethanamine

(2-methoxyphenyl)-thiophen-2-ylmethanamine (PubChem CID 43186740) has the molecular formula C12H13NOS and a molecular weight of 219.31 g/mol. Its IUPAC name is (2-methoxyphenyl)-thiophen-2-ylmethanamine.

Molecular Properties

Compound Name(2-methoxyphenyl)-thiophen-2-ylmethanamine
PubChem CID43186740
Molecular FormulaC12H13NOS
Molecular Weight219.31 g/mol
Exact Mass219.07
IUPAC Name(2-methoxyphenyl)-thiophen-2-ylmethanamine
SMILESCOc1ccccc1C(N)c1cccs1
InChIInChI=1S/C12H13NOS/c1-14-10-6-3-2-5-9(10)12(13)11-7-4-8-15-11/h2-8,12H,13H2,1H3
InChIKeyBZTYQIJZTUNAKS-UHFFFAOYSA-N
XLogP2.80
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.31
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(5-fluoro-2-methoxyphenyl)-thiophen-2-ylmethanamine
CID 43464539
(S)-(4-bromo-2,5-dimethoxyphenyl)-thiophen-2-ylmethanamine;hydrochloride
CID 171214723
1-(2-methoxyphenyl)-N-methyl-1-thiophen-2-ylmethanamine
CID 43483471
2-[(R)-amino(thiophen-2-yl)methyl]-4-fluoro-6-methoxyphenol
CID 171256027
3-amino-2-(2-methoxyphenyl)-1-thiophen-2-ylpropan-1-ol
CID 65190276
(2-fluorophenyl)-thiophen-2-ylmethanamine
CID 43186746
2-[(R)-amino(thiophen-2-yl)methyl]-4-bromo-6-methoxyphenol;hydrochloride
CID 171232515
2-[(S)-amino(thiophen-2-yl)methyl]-4-fluoro-6-methoxyphenol;hydrochloride
CID 171259372
(R)-(4-bromo-3,5-dimethoxyphenyl)-thiophen-2-ylmethanamine
CID 171221826
(R)-(2-methoxynaphthalen-1-yl)-thiophen-2-ylmethanamine
CID 171232570
(S)-(2-methoxynaphthalen-1-yl)-thiophen-2-ylmethanamine
CID 171212951
(S)-(4-chloro-3-methoxyphenyl)-thiophen-2-ylmethanamine;hydrochloride
CID 171211135

Frequently Asked Questions

What is the IUPAC name of (2-methoxyphenyl)-thiophen-2-ylmethanamine?
The IUPAC name of (2-methoxyphenyl)-thiophen-2-ylmethanamine (CID 43186740) is (2-methoxyphenyl)-thiophen-2-ylmethanamine.
What is the SMILES notation for (2-methoxyphenyl)-thiophen-2-ylmethanamine?
The canonical SMILES for (2-methoxyphenyl)-thiophen-2-ylmethanamine is COc1ccccc1C(N)c1cccs1.
What is the InChIKey of (2-methoxyphenyl)-thiophen-2-ylmethanamine?
The InChIKey is BZTYQIJZTUNAKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NOS/c1-14-10-6-3-2-5-9(10)12(13)11-7-4-8-15-11/h2-8,12H,13H2,1H3.
What are the key properties of (2-methoxyphenyl)-thiophen-2-ylmethanamine?
(2-methoxyphenyl)-thiophen-2-ylmethanamine has a molecular weight of 219.31 g/mol, XLogP of 2.80, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methoxyphenyl)-thiophen-2-ylmethanamine is sourced from PubChem (CID 43186740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).