1-(1-ethylsulfanylcyclopropyl)ethanamine

C7H15NS — CID 115011671

IUPAC1-(1-ethylsulfanylcyclopropyl)ethanamine
SMILESCCSC1(C(C)N)CC1
InChIInChI=1S/C7H15NS/c1-3-9-7(4-5-7)6(2)8/h6H,3-5,8H2,1-2H3
InChIKeyLIEAQSMRWRTLAC-UHFFFAOYSA-N
MW145.27 g/mol
LogP1.62
Rot. Bonds3

About 1-(1-ethylsulfanylcyclopropyl)ethanamine

1-(1-ethylsulfanylcyclopropyl)ethanamine (PubChem CID 115011671) has the molecular formula C7H15NS and a molecular weight of 145.27 g/mol. Its IUPAC name is 1-(1-ethylsulfanylcyclopropyl)ethanamine.

Molecular Properties

Compound Name1-(1-ethylsulfanylcyclopropyl)ethanamine
PubChem CID115011671
Molecular FormulaC7H15NS
Molecular Weight145.27 g/mol
Exact Mass145.09
IUPAC Name1-(1-ethylsulfanylcyclopropyl)ethanamine
SMILESCCSC1(C(C)N)CC1
InChIInChI=1S/C7H15NS/c1-3-9-7(4-5-7)6(2)8/h6H,3-5,8H2,1-2H3
InChIKeyLIEAQSMRWRTLAC-UHFFFAOYSA-N
XLogP1.62
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.27
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(1-ethylsulfanylcyclopropyl)ethanamine?
The IUPAC name of 1-(1-ethylsulfanylcyclopropyl)ethanamine (CID 115011671) is 1-(1-ethylsulfanylcyclopropyl)ethanamine.
What is the SMILES notation for 1-(1-ethylsulfanylcyclopropyl)ethanamine?
The canonical SMILES for 1-(1-ethylsulfanylcyclopropyl)ethanamine is CCSC1(C(C)N)CC1.
What is the InChIKey of 1-(1-ethylsulfanylcyclopropyl)ethanamine?
The InChIKey is LIEAQSMRWRTLAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NS/c1-3-9-7(4-5-7)6(2)8/h6H,3-5,8H2,1-2H3.
What are the key properties of 1-(1-ethylsulfanylcyclopropyl)ethanamine?
1-(1-ethylsulfanylcyclopropyl)ethanamine has a molecular weight of 145.27 g/mol, XLogP of 1.62, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethylsulfanylcyclopropyl)ethanamine is sourced from PubChem (CID 115011671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).