1-cyclopentyl-N-ethyl-2-methylsulfonylethanamine

C10H21NO2S — CID 115601066

IUPAC1-cyclopentyl-N-ethyl-2-methylsulfonylethanamine
SMILESCCNC(CS(C)(=O)=O)C1CCCC1
InChIInChI=1S/C10H21NO2S/c1-3-11-10(8-14(2,12)13)9-6-4-5-7-9/h9-11H,3-8H2,1-2H3
InChIKeyIFYAQAMTEFXPAV-UHFFFAOYSA-N
MW219.35 g/mol
LogP1.20
Rot. Bonds5

About 1-cyclopentyl-N-ethyl-2-methylsulfonylethanamine

1-cyclopentyl-N-ethyl-2-methylsulfonylethanamine (PubChem CID 115601066) has the molecular formula C10H21NO2S and a molecular weight of 219.35 g/mol. Its IUPAC name is 1-cyclopentyl-N-ethyl-2-methylsulfonylethanamine.

Molecular Properties

Compound Name1-cyclopentyl-N-ethyl-2-methylsulfonylethanamine
PubChem CID115601066
Molecular FormulaC10H21NO2S
Molecular Weight219.35 g/mol
Exact Mass219.13
IUPAC Name1-cyclopentyl-N-ethyl-2-methylsulfonylethanamine
SMILESCCNC(CS(C)(=O)=O)C1CCCC1
InChIInChI=1S/C10H21NO2S/c1-3-11-10(8-14(2,12)13)9-6-4-5-7-9/h9-11H,3-8H2,1-2H3
InChIKeyIFYAQAMTEFXPAV-UHFFFAOYSA-N
XLogP1.20
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.35
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-cycloheptyl-2-methylsulfonylethyl)propan-1-amine
CID 105027602
1-cyclopentyl-N-ethyl-2-propylsulfonylethanamine
CID 104754033
1-cyclopentyl-N-ethyl-3-methylsulfonylpropan-1-amine
CID 62601414
1-cyclopentyl-N-ethyl-2-(2-methylpropylsulfonyl)ethanamine
CID 104753963
1-cyclohexyl-N-ethylpropan-1-amine
CID 60817829
2-cyclohexylsulfonyl-1-cyclopropyl-N-ethylethanamine
CID 64675598
N-ethyl-2-methylsulfonyl-1-(6-oxaspiro[4.5]decan-9-yl)ethanamine
CID 105016797
1-cyclopropyl-N-ethyl-2-(3-methylbutan-2-ylsulfonyl)ethanamine
CID 107759055
1-cycloheptyl-2-cyclohexyl-N-ethylethanamine
CID 65399491
1,2-di(cycloheptyl)-N-ethylethanamine
CID 105027799
N-(1-cyclohexyl-2-propylsulfonylethyl)propan-1-amine
CID 104754032
1-cyclohexyl-N-ethyldodecan-1-amine
CID 114981553

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-N-ethyl-2-methylsulfonylethanamine?
The IUPAC name of 1-cyclopentyl-N-ethyl-2-methylsulfonylethanamine (CID 115601066) is 1-cyclopentyl-N-ethyl-2-methylsulfonylethanamine.
What is the SMILES notation for 1-cyclopentyl-N-ethyl-2-methylsulfonylethanamine?
The canonical SMILES for 1-cyclopentyl-N-ethyl-2-methylsulfonylethanamine is CCNC(CS(C)(=O)=O)C1CCCC1.
What is the InChIKey of 1-cyclopentyl-N-ethyl-2-methylsulfonylethanamine?
The InChIKey is IFYAQAMTEFXPAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2S/c1-3-11-10(8-14(2,12)13)9-6-4-5-7-9/h9-11H,3-8H2,1-2H3.
What are the key properties of 1-cyclopentyl-N-ethyl-2-methylsulfonylethanamine?
1-cyclopentyl-N-ethyl-2-methylsulfonylethanamine has a molecular weight of 219.35 g/mol, XLogP of 1.20, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-N-ethyl-2-methylsulfonylethanamine is sourced from PubChem (CID 115601066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).