N-cyclopropyl-2-[2-cyclopropyl-2-(ethylamino)ethyl]sulfonylacetamide

C12H22N2O3S — CID 114232785

IUPACN-cyclopropyl-2-[2-cyclopropyl-2-(ethylamino)ethyl]sulfonylacetamide
SMILESCCNC(CS(=O)(=O)CC(=O)NC1CC1)C1CC1
InChIInChI=1S/C12H22N2O3S/c1-2-13-11(9-3-4-9)7-18(16,17)8-12(15)14-10-5-6-10/h9-11,13H,2-8H2,1H3,(H,14,15)
InChIKeyKPGRIKSURAKUJN-UHFFFAOYSA-N
MW274.39 g/mol
LogP0.07
Rot. Bonds8

About N-cyclopropyl-2-[2-cyclopropyl-2-(ethylamino)ethyl]sulfonylacetamide

N-cyclopropyl-2-[2-cyclopropyl-2-(ethylamino)ethyl]sulfonylacetamide (PubChem CID 114232785) has the molecular formula C12H22N2O3S and a molecular weight of 274.39 g/mol. Its IUPAC name is N-cyclopropyl-2-[2-cyclopropyl-2-(ethylamino)ethyl]sulfonylacetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[2-cyclopropyl-2-(ethylamino)ethyl]sulfonylacetamide
PubChem CID114232785
Molecular FormulaC12H22N2O3S
Molecular Weight274.39 g/mol
Exact Mass274.14
IUPAC NameN-cyclopropyl-2-[2-cyclopropyl-2-(ethylamino)ethyl]sulfonylacetamide
SMILESCCNC(CS(=O)(=O)CC(=O)NC1CC1)C1CC1
InChIInChI=1S/C12H22N2O3S/c1-2-13-11(9-3-4-9)7-18(16,17)8-12(15)14-10-5-6-10/h9-11,13H,2-8H2,1H3,(H,14,15)
InChIKeyKPGRIKSURAKUJN-UHFFFAOYSA-N
XLogP0.07
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.39
LogP ≤ 50.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-cyclopentyl-N-ethyl-2-(2-methylpropylsulfonyl)ethanamine
CID 104753963
2-[2-(butan-2-ylamino)ethylsulfonyl]-N-cyclopropylacetamide
CID 114232575
1-cyclopentyl-N-ethyl-2-methylsulfonylethanamine
CID 115601066
2-[2-cyclopentyl-2-(propylamino)ethyl]sulfonylacetamide
CID 114231996
N-cyclopropyl-2-propan-2-ylsulfonylacetamide
CID 87023654
1-cyclopropyl-N-ethyl-2-(3-methylbutan-2-ylsulfonyl)ethanamine
CID 107759055
cis-(1S,3R)-3-[[2-(2-methylpropylsulfonyl)acetyl]amino]cyclopentane-1-carboxylic acid
CID 120676145
2-[(4-octan-2-ylcyclohexyl)amino]-2-oxoethanesulfonic acid
CID 154273931
2-cyclohexylsulfonyl-1-cyclopropyl-N-ethylethanamine
CID 64675598
2-but-2-enylsulfonyl-N-cyclopropylacetamide
CID 76865490
2-(2-methylpropylsulfonyl)-N-pyrrolidin-3-ylacetamide
CID 119454185
N-(1-cyclohexyl-2-propylsulfonylethyl)propan-1-amine
CID 104754032

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[2-cyclopropyl-2-(ethylamino)ethyl]sulfonylacetamide?
The IUPAC name of N-cyclopropyl-2-[2-cyclopropyl-2-(ethylamino)ethyl]sulfonylacetamide (CID 114232785) is N-cyclopropyl-2-[2-cyclopropyl-2-(ethylamino)ethyl]sulfonylacetamide.
What is the SMILES notation for N-cyclopropyl-2-[2-cyclopropyl-2-(ethylamino)ethyl]sulfonylacetamide?
The canonical SMILES for N-cyclopropyl-2-[2-cyclopropyl-2-(ethylamino)ethyl]sulfonylacetamide is CCNC(CS(=O)(=O)CC(=O)NC1CC1)C1CC1.
What is the InChIKey of N-cyclopropyl-2-[2-cyclopropyl-2-(ethylamino)ethyl]sulfonylacetamide?
The InChIKey is KPGRIKSURAKUJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O3S/c1-2-13-11(9-3-4-9)7-18(16,17)8-12(15)14-10-5-6-10/h9-11,13H,2-8H2,1H3,(H,14,15).
What are the key properties of N-cyclopropyl-2-[2-cyclopropyl-2-(ethylamino)ethyl]sulfonylacetamide?
N-cyclopropyl-2-[2-cyclopropyl-2-(ethylamino)ethyl]sulfonylacetamide has a molecular weight of 274.39 g/mol, XLogP of 0.07, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[2-cyclopropyl-2-(ethylamino)ethyl]sulfonylacetamide is sourced from PubChem (CID 114232785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).