(2-methylcyclopentyl)-thiophen-3-ylmethanamine

C11H17NS — CID 107189168

IUPAC(2-methylcyclopentyl)-thiophen-3-ylmethanamine
SMILESCC1CCCC1C(N)c1ccsc1
InChIInChI=1S/C11H17NS/c1-8-3-2-4-10(8)11(12)9-5-6-13-7-9/h5-8,10-11H,2-4,12H2,1H3
InChIKeyYEGCISOTKWLYCP-UHFFFAOYSA-N
MW195.33 g/mol
LogP3.18
Rot. Bonds2

About (2-methylcyclopentyl)-thiophen-3-ylmethanamine

(2-methylcyclopentyl)-thiophen-3-ylmethanamine (PubChem CID 107189168) has the molecular formula C11H17NS and a molecular weight of 195.33 g/mol. Its IUPAC name is (2-methylcyclopentyl)-thiophen-3-ylmethanamine.

Molecular Properties

Compound Name(2-methylcyclopentyl)-thiophen-3-ylmethanamine
PubChem CID107189168
Molecular FormulaC11H17NS
Molecular Weight195.33 g/mol
Exact Mass195.11
IUPAC Name(2-methylcyclopentyl)-thiophen-3-ylmethanamine
SMILESCC1CCCC1C(N)c1ccsc1
InChIInChI=1S/C11H17NS/c1-8-3-2-4-10(8)11(12)9-5-6-13-7-9/h5-8,10-11H,2-4,12H2,1H3
InChIKeyYEGCISOTKWLYCP-UHFFFAOYSA-N
XLogP3.18
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.33
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2-methylcyclopentyl)-thiophen-3-ylmethanamine?
The IUPAC name of (2-methylcyclopentyl)-thiophen-3-ylmethanamine (CID 107189168) is (2-methylcyclopentyl)-thiophen-3-ylmethanamine.
What is the SMILES notation for (2-methylcyclopentyl)-thiophen-3-ylmethanamine?
The canonical SMILES for (2-methylcyclopentyl)-thiophen-3-ylmethanamine is CC1CCCC1C(N)c1ccsc1.
What is the InChIKey of (2-methylcyclopentyl)-thiophen-3-ylmethanamine?
The InChIKey is YEGCISOTKWLYCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NS/c1-8-3-2-4-10(8)11(12)9-5-6-13-7-9/h5-8,10-11H,2-4,12H2,1H3.
What are the key properties of (2-methylcyclopentyl)-thiophen-3-ylmethanamine?
(2-methylcyclopentyl)-thiophen-3-ylmethanamine has a molecular weight of 195.33 g/mol, XLogP of 3.18, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylcyclopentyl)-thiophen-3-ylmethanamine is sourced from PubChem (CID 107189168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).