2-[2-cyclopentyl-2-(propylamino)ethyl]sulfonylacetamide

C12H24N2O3S — CID 114231996

IUPAC2-[2-cyclopentyl-2-(propylamino)ethyl]sulfonylacetamide
SMILESCCCNC(CS(=O)(=O)CC(N)=O)C1CCCC1
InChIInChI=1S/C12H24N2O3S/c1-2-7-14-11(10-5-3-4-6-10)8-18(16,17)9-12(13)15/h10-11,14H,2-9H2,1H3,(H2,13,15)
InChIKeyQUUCGUGJDGWDOI-UHFFFAOYSA-N
MW276.40 g/mol
LogP0.44
Rot. Bonds8

About 2-[2-cyclopentyl-2-(propylamino)ethyl]sulfonylacetamide

2-[2-cyclopentyl-2-(propylamino)ethyl]sulfonylacetamide (PubChem CID 114231996) has the molecular formula C12H24N2O3S and a molecular weight of 276.40 g/mol. Its IUPAC name is 2-[2-cyclopentyl-2-(propylamino)ethyl]sulfonylacetamide.

Molecular Properties

Compound Name2-[2-cyclopentyl-2-(propylamino)ethyl]sulfonylacetamide
PubChem CID114231996
Molecular FormulaC12H24N2O3S
Molecular Weight276.40 g/mol
Exact Mass276.15
IUPAC Name2-[2-cyclopentyl-2-(propylamino)ethyl]sulfonylacetamide
SMILESCCCNC(CS(=O)(=O)CC(N)=O)C1CCCC1
InChIInChI=1S/C12H24N2O3S/c1-2-7-14-11(10-5-3-4-6-10)8-18(16,17)9-12(13)15/h10-11,14H,2-9H2,1H3,(H2,13,15)
InChIKeyQUUCGUGJDGWDOI-UHFFFAOYSA-N
XLogP0.44
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.40
LogP ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-cyclohexyl-2-propylsulfonylethyl)propan-1-amine
CID 104754032
N-[1-cyclopentyl-2-(cyclopentylmethylsulfonyl)ethyl]propan-1-amine
CID 104754263
N-(1-cycloheptyl-2-methylsulfonylethyl)propan-1-amine
CID 105027602
N-[2-(cyclopentylmethylsulfonyl)-1-cyclopropylethyl]propan-1-amine
CID 64674734
1-cyclopentyl-N-ethyl-2-propylsulfonylethanamine
CID 104754033
1-cyclooctyl-4-ethylsulfonyl-N-propylbutan-1-amine
CID 80611662
3-(1-cyclohexylpropylamino)propanamide
CID 62407529
1-cyclododecyl-N-propylpropan-1-amine
CID 79308094
N-cyclopropyl-2-[2-cyclopropyl-2-(ethylamino)ethyl]sulfonylacetamide
CID 114232785
1-cyclopentyl-N-ethyl-2-(2-methylpropylsulfonyl)ethanamine
CID 104753963
1-cyclooctyl-3-methyl-N-propylbutan-1-amine
CID 80611346
1-cyclooctyl-4-methylsulfonyl-N-propylbutan-1-amine
CID 80610576

Frequently Asked Questions

What is the IUPAC name of 2-[2-cyclopentyl-2-(propylamino)ethyl]sulfonylacetamide?
The IUPAC name of 2-[2-cyclopentyl-2-(propylamino)ethyl]sulfonylacetamide (CID 114231996) is 2-[2-cyclopentyl-2-(propylamino)ethyl]sulfonylacetamide.
What is the SMILES notation for 2-[2-cyclopentyl-2-(propylamino)ethyl]sulfonylacetamide?
The canonical SMILES for 2-[2-cyclopentyl-2-(propylamino)ethyl]sulfonylacetamide is CCCNC(CS(=O)(=O)CC(N)=O)C1CCCC1.
What is the InChIKey of 2-[2-cyclopentyl-2-(propylamino)ethyl]sulfonylacetamide?
The InChIKey is QUUCGUGJDGWDOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O3S/c1-2-7-14-11(10-5-3-4-6-10)8-18(16,17)9-12(13)15/h10-11,14H,2-9H2,1H3,(H2,13,15).
What are the key properties of 2-[2-cyclopentyl-2-(propylamino)ethyl]sulfonylacetamide?
2-[2-cyclopentyl-2-(propylamino)ethyl]sulfonylacetamide has a molecular weight of 276.40 g/mol, XLogP of 0.44, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-cyclopentyl-2-(propylamino)ethyl]sulfonylacetamide is sourced from PubChem (CID 114231996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).