6-methoxy-2-thiophen-2-yl-3,4-dihydro-2H-chromen-4-amine

C14H15NO2S — CID 114709810

IUPAC6-methoxy-2-thiophen-2-yl-3,4-dihydro-2H-chromen-4-amine
SMILESCOc1ccc2c(c1)C(N)CC(c1cccs1)O2
InChIInChI=1S/C14H15NO2S/c1-16-9-4-5-12-10(7-9)11(15)8-13(17-12)14-3-2-6-18-14/h2-7,11,13H,8,15H2,1H3
InChIKeyGWKJVCDCRCIPMU-UHFFFAOYSA-N
MW261.35 g/mol
LogP3.28
Rot. Bonds2

About 6-methoxy-2-thiophen-2-yl-3,4-dihydro-2H-chromen-4-amine

6-methoxy-2-thiophen-2-yl-3,4-dihydro-2H-chromen-4-amine (PubChem CID 114709810) has the molecular formula C14H15NO2S and a molecular weight of 261.35 g/mol. Its IUPAC name is 6-methoxy-2-thiophen-2-yl-3,4-dihydro-2H-chromen-4-amine.

Molecular Properties

Compound Name6-methoxy-2-thiophen-2-yl-3,4-dihydro-2H-chromen-4-amine
PubChem CID114709810
Molecular FormulaC14H15NO2S
Molecular Weight261.35 g/mol
Exact Mass261.08
IUPAC Name6-methoxy-2-thiophen-2-yl-3,4-dihydro-2H-chromen-4-amine
SMILESCOc1ccc2c(c1)C(N)CC(c1cccs1)O2
InChIInChI=1S/C14H15NO2S/c1-16-9-4-5-12-10(7-9)11(15)8-13(17-12)14-3-2-6-18-14/h2-7,11,13H,8,15H2,1H3
InChIKeyGWKJVCDCRCIPMU-UHFFFAOYSA-N
XLogP3.28
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.35
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(4R)-2-thiophen-2-yl-3,4-dihydro-2H-chromen-4-amine
CID 104946079
2-(4-bromo-5-methylthiophen-2-yl)-6-methoxy-3,4-dihydro-2H-chromen-4-amine
CID 102846073
(4S)-6-methoxy-2-(1,3-thiazol-2-yl)-3,4-dihydro-2H-chromen-4-amine
CID 104946802
(4S)-6-methoxy-2-(2-methylphenyl)-3,4-dihydro-2H-chromen-4-amine
CID 104946910
(4R)-2-(2,6-difluorophenyl)-6-methoxy-3,4-dihydro-2H-chromen-4-amine
CID 104947106
(4S)-2-(2-bromo-4-chlorophenyl)-6-methoxy-3,4-dihydro-2H-chromen-4-amine
CID 104946930
N-ethyl-7-methoxy-2-thiophen-2-yl-3,4-dihydro-2H-chromen-4-amine
CID 114710968
2-(3,4-dimethylphenyl)-6-methoxy-3,4-dihydro-2H-chromen-4-amine
CID 114709843
7-bromo-2-thiophen-2-yl-3,4-dihydro-2H-chromen-4-amine
CID 114709140
(4S)-6-methoxy-2-(3-methylimidazol-4-yl)-3,4-dihydro-2H-chromen-4-amine
CID 104946805
6-methoxy-2-(3-methylimidazol-4-yl)-3,4-dihydro-2H-chromen-4-amine
CID 114709851
2-(4-bromo-2-chlorophenyl)-6-methoxy-3,4-dihydro-2H-chromen-4-amine
CID 114709925

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2-thiophen-2-yl-3,4-dihydro-2H-chromen-4-amine?
The IUPAC name of 6-methoxy-2-thiophen-2-yl-3,4-dihydro-2H-chromen-4-amine (CID 114709810) is 6-methoxy-2-thiophen-2-yl-3,4-dihydro-2H-chromen-4-amine.
What is the SMILES notation for 6-methoxy-2-thiophen-2-yl-3,4-dihydro-2H-chromen-4-amine?
The canonical SMILES for 6-methoxy-2-thiophen-2-yl-3,4-dihydro-2H-chromen-4-amine is COc1ccc2c(c1)C(N)CC(c1cccs1)O2.
What is the InChIKey of 6-methoxy-2-thiophen-2-yl-3,4-dihydro-2H-chromen-4-amine?
The InChIKey is GWKJVCDCRCIPMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO2S/c1-16-9-4-5-12-10(7-9)11(15)8-13(17-12)14-3-2-6-18-14/h2-7,11,13H,8,15H2,1H3.
What are the key properties of 6-methoxy-2-thiophen-2-yl-3,4-dihydro-2H-chromen-4-amine?
6-methoxy-2-thiophen-2-yl-3,4-dihydro-2H-chromen-4-amine has a molecular weight of 261.35 g/mol, XLogP of 3.28, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2-thiophen-2-yl-3,4-dihydro-2H-chromen-4-amine is sourced from PubChem (CID 114709810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).