N-(2-cyclopentylethyl)thiolan-3-amine

C11H21NS — CID 60920682

IUPACN-(2-cyclopentylethyl)thiolan-3-amine
SMILESC1CCC(CCNC2CCSC2)C1
InChIInChI=1S/C11H21NS/c1-2-4-10(3-1)5-7-12-11-6-8-13-9-11/h10-12H,1-9H2
InChIKeyFSHBOEQJRJTMPX-UHFFFAOYSA-N
MW199.36 g/mol
LogP2.66
Rot. Bonds4

About N-(2-cyclopentylethyl)thiolan-3-amine

N-(2-cyclopentylethyl)thiolan-3-amine (PubChem CID 60920682) has the molecular formula C11H21NS and a molecular weight of 199.36 g/mol. Its IUPAC name is N-(2-cyclopentylethyl)thiolan-3-amine.

Molecular Properties

Compound NameN-(2-cyclopentylethyl)thiolan-3-amine
PubChem CID60920682
Molecular FormulaC11H21NS
Molecular Weight199.36 g/mol
Exact Mass199.14
IUPAC NameN-(2-cyclopentylethyl)thiolan-3-amine
SMILESC1CCC(CCNC2CCSC2)C1
InChIInChI=1S/C11H21NS/c1-2-4-10(3-1)5-7-12-11-6-8-13-9-11/h10-12H,1-9H2
InChIKeyFSHBOEQJRJTMPX-UHFFFAOYSA-N
XLogP2.66
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.36
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopentylethyl)thiolan-3-amine?
The IUPAC name of N-(2-cyclopentylethyl)thiolan-3-amine (CID 60920682) is N-(2-cyclopentylethyl)thiolan-3-amine.
What is the SMILES notation for N-(2-cyclopentylethyl)thiolan-3-amine?
The canonical SMILES for N-(2-cyclopentylethyl)thiolan-3-amine is C1CCC(CCNC2CCSC2)C1.
What is the InChIKey of N-(2-cyclopentylethyl)thiolan-3-amine?
The InChIKey is FSHBOEQJRJTMPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NS/c1-2-4-10(3-1)5-7-12-11-6-8-13-9-11/h10-12H,1-9H2.
What are the key properties of N-(2-cyclopentylethyl)thiolan-3-amine?
N-(2-cyclopentylethyl)thiolan-3-amine has a molecular weight of 199.36 g/mol, XLogP of 2.66, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopentylethyl)thiolan-3-amine is sourced from PubChem (CID 60920682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).