N-cyclopropyl-2-propan-2-ylsulfonylacetamide

C8H15NO3S — CID 87023654

IUPACN-cyclopropyl-2-propan-2-ylsulfonylacetamide
SMILESCC(C)S(=O)(=O)CC(=O)NC1CC1
InChIInChI=1S/C8H15NO3S/c1-6(2)13(11,12)5-8(10)9-7-3-4-7/h6-7H,3-5H2,1-2H3,(H,9,10)
InChIKeyOIEKQXKVIUJLPR-UHFFFAOYSA-N
MW205.28 g/mol
LogP0.09
Rot. Bonds4

About N-cyclopropyl-2-propan-2-ylsulfonylacetamide

N-cyclopropyl-2-propan-2-ylsulfonylacetamide (PubChem CID 87023654) has the molecular formula C8H15NO3S and a molecular weight of 205.28 g/mol. Its IUPAC name is N-cyclopropyl-2-propan-2-ylsulfonylacetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-propan-2-ylsulfonylacetamide
PubChem CID87023654
Molecular FormulaC8H15NO3S
Molecular Weight205.28 g/mol
Exact Mass205.08
IUPAC NameN-cyclopropyl-2-propan-2-ylsulfonylacetamide
SMILESCC(C)S(=O)(=O)CC(=O)NC1CC1
InChIInChI=1S/C8H15NO3S/c1-6(2)13(11,12)5-8(10)9-7-3-4-7/h6-7H,3-5H2,1-2H3,(H,9,10)
InChIKeyOIEKQXKVIUJLPR-UHFFFAOYSA-N
XLogP0.09
TPSA63.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.28
LogP ≤ 50.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(cyclopropylamino)-2-oxoethyl]sulfonyl-3-methylbutanoic acid
CID 105354775
3-[2-(cyclopropylamino)-2-oxoethyl]sulfonylbutanoic acid
CID 66114123
methyl 3-[2-(cyclopropylamino)-2-oxoethyl]sulfonyl-2-methylbutanoate
CID 114232365
2-[2-(butan-2-ylamino)ethylsulfonyl]-N-cyclopropylacetamide
CID 114232575
2-but-2-enylsulfonyl-N-cyclopropylacetamide
CID 76865490
N-(2-methyl-4-oxopentan-3-yl)-2-propan-2-ylsulfonylacetamide
CID 64637702
N,N'-dicyclopropylbutanediamide
CID 5225156
N-[1-(3-chloro-4-fluorophenyl)pyrrolidin-3-yl]-2-propan-2-ylsulfonylacetamide
CID 131961110
N-cyclopropyl-4-(1-methylsulfonylpropan-2-ylamino)butanamide
CID 79394021
N-cyclopropyl-2-[2-cyclopropyl-2-(ethylamino)ethyl]sulfonylacetamide
CID 114232785
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

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-propan-2-ylsulfonylacetamide?
The IUPAC name of N-cyclopropyl-2-propan-2-ylsulfonylacetamide (CID 87023654) is N-cyclopropyl-2-propan-2-ylsulfonylacetamide.
What is the SMILES notation for N-cyclopropyl-2-propan-2-ylsulfonylacetamide?
The canonical SMILES for N-cyclopropyl-2-propan-2-ylsulfonylacetamide is CC(C)S(=O)(=O)CC(=O)NC1CC1.
What is the InChIKey of N-cyclopropyl-2-propan-2-ylsulfonylacetamide?
The InChIKey is OIEKQXKVIUJLPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO3S/c1-6(2)13(11,12)5-8(10)9-7-3-4-7/h6-7H,3-5H2,1-2H3,(H,9,10).
What are the key properties of N-cyclopropyl-2-propan-2-ylsulfonylacetamide?
N-cyclopropyl-2-propan-2-ylsulfonylacetamide has a molecular weight of 205.28 g/mol, XLogP of 0.09, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-propan-2-ylsulfonylacetamide is sourced from PubChem (CID 87023654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).