6-(2-aminoethyl)-5-methyl-4,5-dihydrocyclopenta[b]thiophen-6-ol

C10H15NOS — CID 112715527

IUPAC6-(2-aminoethyl)-5-methyl-4,5-dihydrocyclopenta[b]thiophen-6-ol
SMILESCC1Cc2ccsc2C1(O)CCN
InChIInChI=1S/C10H15NOS/c1-7-6-8-2-5-13-9(8)10(7,12)3-4-11/h2,5,7,12H,3-4,6,11H2,1H3
InChIKeyQGEZQVHVMHFRGT-UHFFFAOYSA-N
MW197.30 g/mol
LogP1.48
Rot. Bonds2

About 6-(2-aminoethyl)-5-methyl-4,5-dihydrocyclopenta[b]thiophen-6-ol

6-(2-aminoethyl)-5-methyl-4,5-dihydrocyclopenta[b]thiophen-6-ol (PubChem CID 112715527) has the molecular formula C10H15NOS and a molecular weight of 197.30 g/mol. Its IUPAC name is 6-(2-aminoethyl)-5-methyl-4,5-dihydrocyclopenta[b]thiophen-6-ol.

Molecular Properties

Compound Name6-(2-aminoethyl)-5-methyl-4,5-dihydrocyclopenta[b]thiophen-6-ol
PubChem CID112715527
Molecular FormulaC10H15NOS
Molecular Weight197.30 g/mol
Exact Mass197.09
IUPAC Name6-(2-aminoethyl)-5-methyl-4,5-dihydrocyclopenta[b]thiophen-6-ol
SMILESCC1Cc2ccsc2C1(O)CCN
InChIInChI=1S/C10H15NOS/c1-7-6-8-2-5-13-9(8)10(7,12)3-4-11/h2,5,7,12H,3-4,6,11H2,1H3
InChIKeyQGEZQVHVMHFRGT-UHFFFAOYSA-N
XLogP1.48
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.30
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(aminomethyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-5-ol
CID 89358901
4-Amino-2-(4-methylthiophen-2-yl)butan-2-ol
CID 123975252
4-(Aminomethyl)-5,6-dihydrocyclopenta[b]thiophen-4-ol
CID 55269075
3-amino-1-{4H,5H,6H-cyclopenta[b]thiophen-2-yl}propan-1-ol
CID 65184957
2-(aminomethyl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-3-methylbutan-1-ol
CID 65185489
2-(Aminomethyl)-3-methyl-1-(3-methylthiophen-2-yl)butan-1-ol
CID 65185797
2-(aminomethyl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-4-methylpentan-1-ol
CID 65188195
2-(aminomethyl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)butan-1-ol
CID 65188223
3-amino-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2-methylpropan-1-ol
CID 65190411
4-Amino-2-(5-methylthiophen-2-yl)butan-2-ol
CID 65985722
4-Amino-2-(5-methylthiophen-3-yl)butan-2-ol
CID 65987179
3-(Aminomethyl)-2-(3-methylthiophen-2-yl)pentan-2-ol
CID 79123411

Frequently Asked Questions

What is the IUPAC name of 6-(2-aminoethyl)-5-methyl-4,5-dihydrocyclopenta[b]thiophen-6-ol?
The IUPAC name of 6-(2-aminoethyl)-5-methyl-4,5-dihydrocyclopenta[b]thiophen-6-ol (CID 112715527) is 6-(2-aminoethyl)-5-methyl-4,5-dihydrocyclopenta[b]thiophen-6-ol.
What is the SMILES notation for 6-(2-aminoethyl)-5-methyl-4,5-dihydrocyclopenta[b]thiophen-6-ol?
The canonical SMILES for 6-(2-aminoethyl)-5-methyl-4,5-dihydrocyclopenta[b]thiophen-6-ol is CC1Cc2ccsc2C1(O)CCN.
What is the InChIKey of 6-(2-aminoethyl)-5-methyl-4,5-dihydrocyclopenta[b]thiophen-6-ol?
The InChIKey is QGEZQVHVMHFRGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NOS/c1-7-6-8-2-5-13-9(8)10(7,12)3-4-11/h2,5,7,12H,3-4,6,11H2,1H3.
What are the key properties of 6-(2-aminoethyl)-5-methyl-4,5-dihydrocyclopenta[b]thiophen-6-ol?
6-(2-aminoethyl)-5-methyl-4,5-dihydrocyclopenta[b]thiophen-6-ol has a molecular weight of 197.30 g/mol, XLogP of 1.48, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-aminoethyl)-5-methyl-4,5-dihydrocyclopenta[b]thiophen-6-ol is sourced from PubChem (CID 112715527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).