N-cyclopropyl-4-methylthiophen-3-amine

C8H11NS — CID 131165615

IUPACN-cyclopropyl-4-methylthiophen-3-amine
SMILESCc1cscc1NC1CC1
InChIInChI=1S/C8H11NS/c1-6-4-10-5-8(6)9-7-2-3-7/h4-5,7,9H,2-3H2,1H3
InChIKeyIUAUDVMEUSTMTQ-UHFFFAOYSA-N
MW153.25 g/mol
LogP2.63
Rot. Bonds2

About N-cyclopropyl-4-methylthiophen-3-amine

N-cyclopropyl-4-methylthiophen-3-amine (PubChem CID 131165615) has the molecular formula C8H11NS and a molecular weight of 153.25 g/mol. Its IUPAC name is N-cyclopropyl-4-methylthiophen-3-amine.

Molecular Properties

Compound NameN-cyclopropyl-4-methylthiophen-3-amine
PubChem CID131165615
Molecular FormulaC8H11NS
Molecular Weight153.25 g/mol
Exact Mass153.06
IUPAC NameN-cyclopropyl-4-methylthiophen-3-amine
SMILESCc1cscc1NC1CC1
InChIInChI=1S/C8H11NS/c1-6-4-10-5-8(6)9-7-2-3-7/h4-5,7,9H,2-3H2,1H3
InChIKeyIUAUDVMEUSTMTQ-UHFFFAOYSA-N
XLogP2.63
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.25
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-methylthiophen-3-amine?
The IUPAC name of N-cyclopropyl-4-methylthiophen-3-amine (CID 131165615) is N-cyclopropyl-4-methylthiophen-3-amine.
What is the SMILES notation for N-cyclopropyl-4-methylthiophen-3-amine?
The canonical SMILES for N-cyclopropyl-4-methylthiophen-3-amine is Cc1cscc1NC1CC1.
What is the InChIKey of N-cyclopropyl-4-methylthiophen-3-amine?
The InChIKey is IUAUDVMEUSTMTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NS/c1-6-4-10-5-8(6)9-7-2-3-7/h4-5,7,9H,2-3H2,1H3.
What are the key properties of N-cyclopropyl-4-methylthiophen-3-amine?
N-cyclopropyl-4-methylthiophen-3-amine has a molecular weight of 153.25 g/mol, XLogP of 2.63, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-methylthiophen-3-amine is sourced from PubChem (CID 131165615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).