1-cyclopentyl-2-propan-2-ylsulfonylethanamine

C10H21NO2S — CID 104754148

IUPAC1-cyclopentyl-2-propan-2-ylsulfonylethanamine
SMILESCC(C)S(=O)(=O)CC(N)C1CCCC1
InChIInChI=1S/C10H21NO2S/c1-8(2)14(12,13)7-10(11)9-5-3-4-6-9/h8-10H,3-7,11H2,1-2H3
InChIKeyGJQXWRJZGFYUFX-UHFFFAOYSA-N
MW219.35 g/mol
LogP1.33
Rot. Bonds4

About 1-cyclopentyl-2-propan-2-ylsulfonylethanamine

1-cyclopentyl-2-propan-2-ylsulfonylethanamine (PubChem CID 104754148) has the molecular formula C10H21NO2S and a molecular weight of 219.35 g/mol. Its IUPAC name is 1-cyclopentyl-2-propan-2-ylsulfonylethanamine.

Molecular Properties

Compound Name1-cyclopentyl-2-propan-2-ylsulfonylethanamine
PubChem CID104754148
Molecular FormulaC10H21NO2S
Molecular Weight219.35 g/mol
Exact Mass219.13
IUPAC Name1-cyclopentyl-2-propan-2-ylsulfonylethanamine
SMILESCC(C)S(=O)(=O)CC(N)C1CCCC1
InChIInChI=1S/C10H21NO2S/c1-8(2)14(12,13)7-10(11)9-5-3-4-6-9/h8-10H,3-7,11H2,1-2H3
InChIKeyGJQXWRJZGFYUFX-UHFFFAOYSA-N
XLogP1.33
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.35
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-benzylsulfonyl-1-cyclopentylethanamine
CID 104753906
cyclohexyl(ethylsulfonyl)methanamine
CID 54085731
N-(2-amino-2-cyclopropylethyl)propane-2-sulfonamide
CID 63764902
1-cyclohexyl-N'-methyl-N'-(2-methylsulfonylethyl)ethane-1,2-diamine
CID 104746719
(2R,3R,4S)-4-amino-6-cyclohexyl-1-propan-2-ylsulfonylhexane-2,3-diol
CID 18632652
2-cyclopentyl-4-propan-2-ylsulfonylbutan-1-ol
CID 106734435
(1S)-1-cyclopentylethane-1,2-diamine
CID 55292792
1-cyclopentyl-2-methylsulfanylethanamine
CID 62691520
1-cyclohexyl-3-ethylpentan-1-amine
CID 82920637
(2R,4R)-4-amino-4-cyclohexylbutan-2-ol
CID 131096382
1-cyclopentyl-N-methyl-4-propan-2-ylsulfonylbutan-1-amine
CID 106727336
1-cyclohexyl-2-(2,6-dichlorophenyl)sulfonylethanamine
CID 104754082

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-2-propan-2-ylsulfonylethanamine?
The IUPAC name of 1-cyclopentyl-2-propan-2-ylsulfonylethanamine (CID 104754148) is 1-cyclopentyl-2-propan-2-ylsulfonylethanamine.
What is the SMILES notation for 1-cyclopentyl-2-propan-2-ylsulfonylethanamine?
The canonical SMILES for 1-cyclopentyl-2-propan-2-ylsulfonylethanamine is CC(C)S(=O)(=O)CC(N)C1CCCC1.
What is the InChIKey of 1-cyclopentyl-2-propan-2-ylsulfonylethanamine?
The InChIKey is GJQXWRJZGFYUFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2S/c1-8(2)14(12,13)7-10(11)9-5-3-4-6-9/h8-10H,3-7,11H2,1-2H3.
What are the key properties of 1-cyclopentyl-2-propan-2-ylsulfonylethanamine?
1-cyclopentyl-2-propan-2-ylsulfonylethanamine has a molecular weight of 219.35 g/mol, XLogP of 1.33, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-2-propan-2-ylsulfonylethanamine is sourced from PubChem (CID 104754148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).