2-[cyclohexyl(methylsulfonyl)amino]-N-cyclopropylacetamide

C12H22N2O3S — CID 848395

IUPAC2-[cyclohexyl(methylsulfonyl)amino]-N-cyclopropylacetamide
SMILESCS(=O)(=O)N(CC(=O)NC1CC1)C1CCCCC1
InChIInChI=1S/C12H22N2O3S/c1-18(16,17)14(11-5-3-2-4-6-11)9-12(15)13-10-7-8-10/h10-11H,2-9H2,1H3,(H,13,15)
InChIKeyFVOKSKZTLQPYQN-UHFFFAOYSA-N
MW274.39 g/mol
LogP0.86
Rot. Bonds5

About 2-[cyclohexyl(methylsulfonyl)amino]-N-cyclopropylacetamide

2-[cyclohexyl(methylsulfonyl)amino]-N-cyclopropylacetamide (PubChem CID 848395) has the molecular formula C12H22N2O3S and a molecular weight of 274.39 g/mol. Its IUPAC name is 2-[cyclohexyl(methylsulfonyl)amino]-N-cyclopropylacetamide.

Molecular Properties

Compound Name2-[cyclohexyl(methylsulfonyl)amino]-N-cyclopropylacetamide
PubChem CID848395
Molecular FormulaC12H22N2O3S
Molecular Weight274.39 g/mol
Exact Mass274.14
IUPAC Name2-[cyclohexyl(methylsulfonyl)amino]-N-cyclopropylacetamide
SMILESCS(=O)(=O)N(CC(=O)NC1CC1)C1CCCCC1
InChIInChI=1S/C12H22N2O3S/c1-18(16,17)14(11-5-3-2-4-6-11)9-12(15)13-10-7-8-10/h10-11H,2-9H2,1H3,(H,13,15)
InChIKeyFVOKSKZTLQPYQN-UHFFFAOYSA-N
XLogP0.86
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.39
LogP ≤ 50.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[cyclohexyl(methylsulfonyl)amino]-N-cyclopropylacetamide?
The IUPAC name of 2-[cyclohexyl(methylsulfonyl)amino]-N-cyclopropylacetamide (CID 848395) is 2-[cyclohexyl(methylsulfonyl)amino]-N-cyclopropylacetamide.
What is the SMILES notation for 2-[cyclohexyl(methylsulfonyl)amino]-N-cyclopropylacetamide?
The canonical SMILES for 2-[cyclohexyl(methylsulfonyl)amino]-N-cyclopropylacetamide is CS(=O)(=O)N(CC(=O)NC1CC1)C1CCCCC1.
What is the InChIKey of 2-[cyclohexyl(methylsulfonyl)amino]-N-cyclopropylacetamide?
The InChIKey is FVOKSKZTLQPYQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O3S/c1-18(16,17)14(11-5-3-2-4-6-11)9-12(15)13-10-7-8-10/h10-11H,2-9H2,1H3,(H,13,15).
What are the key properties of 2-[cyclohexyl(methylsulfonyl)amino]-N-cyclopropylacetamide?
2-[cyclohexyl(methylsulfonyl)amino]-N-cyclopropylacetamide has a molecular weight of 274.39 g/mol, XLogP of 0.86, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclohexyl(methylsulfonyl)amino]-N-cyclopropylacetamide is sourced from PubChem (CID 848395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).