(2-ethylsulfanylcyclopentyl)methanamine

C8H17NS — CID 43530032

IUPAC(2-ethylsulfanylcyclopentyl)methanamine
SMILESCCSC1CCCC1CN
InChIInChI=1S/C8H17NS/c1-2-10-8-5-3-4-7(8)6-9/h7-8H,2-6,9H2,1H3
InChIKeyCFEQLXMXBCJEHD-UHFFFAOYSA-N
MW159.30 g/mol
LogP1.87
Rot. Bonds3

About (2-ethylsulfanylcyclopentyl)methanamine

(2-ethylsulfanylcyclopentyl)methanamine (PubChem CID 43530032) has the molecular formula C8H17NS and a molecular weight of 159.30 g/mol. Its IUPAC name is (2-ethylsulfanylcyclopentyl)methanamine.

Molecular Properties

Compound Name(2-ethylsulfanylcyclopentyl)methanamine
PubChem CID43530032
Molecular FormulaC8H17NS
Molecular Weight159.30 g/mol
Exact Mass159.11
IUPAC Name(2-ethylsulfanylcyclopentyl)methanamine
SMILESCCSC1CCCC1CN
InChIInChI=1S/C8H17NS/c1-2-10-8-5-3-4-7(8)6-9/h7-8H,2-6,9H2,1H3
InChIKeyCFEQLXMXBCJEHD-UHFFFAOYSA-N
XLogP1.87
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.30
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2-ethylsulfanylcyclopentyl)methanamine?
The IUPAC name of (2-ethylsulfanylcyclopentyl)methanamine (CID 43530032) is (2-ethylsulfanylcyclopentyl)methanamine.
What is the SMILES notation for (2-ethylsulfanylcyclopentyl)methanamine?
The canonical SMILES for (2-ethylsulfanylcyclopentyl)methanamine is CCSC1CCCC1CN.
What is the InChIKey of (2-ethylsulfanylcyclopentyl)methanamine?
The InChIKey is CFEQLXMXBCJEHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NS/c1-2-10-8-5-3-4-7(8)6-9/h7-8H,2-6,9H2,1H3.
What are the key properties of (2-ethylsulfanylcyclopentyl)methanamine?
(2-ethylsulfanylcyclopentyl)methanamine has a molecular weight of 159.30 g/mol, XLogP of 1.87, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethylsulfanylcyclopentyl)methanamine is sourced from PubChem (CID 43530032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).