4-cyclopropyl-5-methylthiophen-3-amine

C8H11NS — CID 114749304

IUPAC4-cyclopropyl-5-methylthiophen-3-amine
SMILESCc1scc(N)c1C1CC1
InChIInChI=1S/C8H11NS/c1-5-8(6-2-3-6)7(9)4-10-5/h4,6H,2-3,9H2,1H3
InChIKeyZQLRKQLCFYPNDR-UHFFFAOYSA-N
MW153.25 g/mol
LogP2.52
Rot. Bonds1

About 4-cyclopropyl-5-methylthiophen-3-amine

4-cyclopropyl-5-methylthiophen-3-amine (PubChem CID 114749304) has the molecular formula C8H11NS and a molecular weight of 153.25 g/mol. Its IUPAC name is 4-cyclopropyl-5-methylthiophen-3-amine.

Molecular Properties

Compound Name4-cyclopropyl-5-methylthiophen-3-amine
PubChem CID114749304
Molecular FormulaC8H11NS
Molecular Weight153.25 g/mol
Exact Mass153.06
IUPAC Name4-cyclopropyl-5-methylthiophen-3-amine
SMILESCc1scc(N)c1C1CC1
InChIInChI=1S/C8H11NS/c1-5-8(6-2-3-6)7(9)4-10-5/h4,6H,2-3,9H2,1H3
InChIKeyZQLRKQLCFYPNDR-UHFFFAOYSA-N
XLogP2.52
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.25
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-cyclopropyl-5-methylthiophen-3-amine?
The IUPAC name of 4-cyclopropyl-5-methylthiophen-3-amine (CID 114749304) is 4-cyclopropyl-5-methylthiophen-3-amine.
What is the SMILES notation for 4-cyclopropyl-5-methylthiophen-3-amine?
The canonical SMILES for 4-cyclopropyl-5-methylthiophen-3-amine is Cc1scc(N)c1C1CC1.
What is the InChIKey of 4-cyclopropyl-5-methylthiophen-3-amine?
The InChIKey is ZQLRKQLCFYPNDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NS/c1-5-8(6-2-3-6)7(9)4-10-5/h4,6H,2-3,9H2,1H3.
What are the key properties of 4-cyclopropyl-5-methylthiophen-3-amine?
4-cyclopropyl-5-methylthiophen-3-amine has a molecular weight of 153.25 g/mol, XLogP of 2.52, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropyl-5-methylthiophen-3-amine is sourced from PubChem (CID 114749304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).