3-(1-methylcyclopropyl)-5,6-dihydro-4H-thieno[3,4-c]pyrrole

C10H13NS — CID 15284968

IUPAC3-(1-methylcyclopropyl)-5,6-dihydro-4H-thieno[3,4-c]pyrrole
SMILESCC1(c2scc3c2CNC3)CC1
InChIInChI=1S/C10H13NS/c1-10(2-3-10)9-8-5-11-4-7(8)6-12-9/h6,11H,2-5H2,1H3
InChIKeyGDLAYDUNUXCLAS-UHFFFAOYSA-N
MW179.29 g/mol
LogP2.40
Rot. Bonds1

About 3-(1-methylcyclopropyl)-5,6-dihydro-4H-thieno[3,4-c]pyrrole

3-(1-methylcyclopropyl)-5,6-dihydro-4H-thieno[3,4-c]pyrrole (PubChem CID 15284968) has the molecular formula C10H13NS and a molecular weight of 179.29 g/mol. Its IUPAC name is 3-(1-methylcyclopropyl)-5,6-dihydro-4H-thieno[3,4-c]pyrrole.

Molecular Properties

Compound Name3-(1-methylcyclopropyl)-5,6-dihydro-4H-thieno[3,4-c]pyrrole
PubChem CID15284968
Molecular FormulaC10H13NS
Molecular Weight179.29 g/mol
Exact Mass179.08
IUPAC Name3-(1-methylcyclopropyl)-5,6-dihydro-4H-thieno[3,4-c]pyrrole
SMILESCC1(c2scc3c2CNC3)CC1
InChIInChI=1S/C10H13NS/c1-10(2-3-10)9-8-5-11-4-7(8)6-12-9/h6,11H,2-5H2,1H3
InChIKeyGDLAYDUNUXCLAS-UHFFFAOYSA-N
XLogP2.40
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.29
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(4,4-dimethyl-5,6-dihydrocyclopenta[b]thiophen-3-yl)methyl]-2,2-difluoroethanamine
CID 114749087
N-(5,6-dihydro-4H-cyclopenta[b]thiophen-3-ylmethyl)-2,2-difluoroethanamine
CID 114749130
N-[(4-cyclopropyl-5-methylthiophen-3-yl)methyl]-2,2,2-trifluoroethanamine
CID 114749156
N-[(4,4-dimethyl-5,6-dihydrocyclopenta[b]thiophen-3-yl)methyl]-2,2,2-trifluoroethanamine
CID 114749162
N-(5,6-dihydro-4H-cyclopenta[b]thiophen-3-ylmethyl)-2,2,2-trifluoroethanamine
CID 114749202
1-Methyl-5,6-dihydro-4H-thieno[3,4-c]pyrrole hydrobromide
CID 18947035
3-methyl-5,6-dihydro-4H-thieno[3,4-c]pyrrole
CID 18947036
1-ethyl-5,6-dihydro-4H-thieno-[3,4-c]pyrrole hydrochloride
CID 18947038
3-ethyl-5,6-dihydro-4H-thieno[3,4-c]pyrrole
CID 18947039
1,3-dimethyl-5,6-dihydro-4H-thieno[3,4-c]pyrrole
CID 18947040
1-Isopropyl-5,6-dihydro-4H-thieno[3,4-c]pyrrole
CID 18947043
2,6-dimethyl-5,6-dihydro-4H-thieno[2,3-c]pyrrole
CID 20763701

Frequently Asked Questions

What is the IUPAC name of 3-(1-methylcyclopropyl)-5,6-dihydro-4H-thieno[3,4-c]pyrrole?
The IUPAC name of 3-(1-methylcyclopropyl)-5,6-dihydro-4H-thieno[3,4-c]pyrrole (CID 15284968) is 3-(1-methylcyclopropyl)-5,6-dihydro-4H-thieno[3,4-c]pyrrole.
What is the SMILES notation for 3-(1-methylcyclopropyl)-5,6-dihydro-4H-thieno[3,4-c]pyrrole?
The canonical SMILES for 3-(1-methylcyclopropyl)-5,6-dihydro-4H-thieno[3,4-c]pyrrole is CC1(c2scc3c2CNC3)CC1.
What is the InChIKey of 3-(1-methylcyclopropyl)-5,6-dihydro-4H-thieno[3,4-c]pyrrole?
The InChIKey is GDLAYDUNUXCLAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NS/c1-10(2-3-10)9-8-5-11-4-7(8)6-12-9/h6,11H,2-5H2,1H3.
What are the key properties of 3-(1-methylcyclopropyl)-5,6-dihydro-4H-thieno[3,4-c]pyrrole?
3-(1-methylcyclopropyl)-5,6-dihydro-4H-thieno[3,4-c]pyrrole has a molecular weight of 179.29 g/mol, XLogP of 2.40, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-methylcyclopropyl)-5,6-dihydro-4H-thieno[3,4-c]pyrrole is sourced from PubChem (CID 15284968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).