N-(cyclopropylmethyl)-2-[methyl(methylsulfonyl)amino]-N-propylacetamide

C11H22N2O3S — CID 86929554

IUPACN-(cyclopropylmethyl)-2-[methyl(methylsulfonyl)amino]-N-propylacetamide
SMILESCCCN(CC1CC1)C(=O)CN(C)S(C)(=O)=O
InChIInChI=1S/C11H22N2O3S/c1-4-7-13(8-10-5-6-10)11(14)9-12(2)17(3,15)16/h10H,4-9H2,1-3H3
InChIKeyYIROAJYOZZEOQM-UHFFFAOYSA-N
MW262.37 g/mol
LogP0.53
Rot. Bonds7

About N-(cyclopropylmethyl)-2-[methyl(methylsulfonyl)amino]-N-propylacetamide

N-(cyclopropylmethyl)-2-[methyl(methylsulfonyl)amino]-N-propylacetamide (PubChem CID 86929554) has the molecular formula C11H22N2O3S and a molecular weight of 262.37 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-2-[methyl(methylsulfonyl)amino]-N-propylacetamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-2-[methyl(methylsulfonyl)amino]-N-propylacetamide
PubChem CID86929554
Molecular FormulaC11H22N2O3S
Molecular Weight262.37 g/mol
Exact Mass262.14
IUPAC NameN-(cyclopropylmethyl)-2-[methyl(methylsulfonyl)amino]-N-propylacetamide
SMILESCCCN(CC1CC1)C(=O)CN(C)S(C)(=O)=O
InChIInChI=1S/C11H22N2O3S/c1-4-7-13(8-10-5-6-10)11(14)9-12(2)17(3,15)16/h10H,4-9H2,1-3H3
InChIKeyYIROAJYOZZEOQM-UHFFFAOYSA-N
XLogP0.53
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.37
LogP ≤ 50.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-2-[methyl(methylsulfonyl)amino]-N-propylacetamide?
The IUPAC name of N-(cyclopropylmethyl)-2-[methyl(methylsulfonyl)amino]-N-propylacetamide (CID 86929554) is N-(cyclopropylmethyl)-2-[methyl(methylsulfonyl)amino]-N-propylacetamide.
What is the SMILES notation for N-(cyclopropylmethyl)-2-[methyl(methylsulfonyl)amino]-N-propylacetamide?
The canonical SMILES for N-(cyclopropylmethyl)-2-[methyl(methylsulfonyl)amino]-N-propylacetamide is CCCN(CC1CC1)C(=O)CN(C)S(C)(=O)=O.
What is the InChIKey of N-(cyclopropylmethyl)-2-[methyl(methylsulfonyl)amino]-N-propylacetamide?
The InChIKey is YIROAJYOZZEOQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O3S/c1-4-7-13(8-10-5-6-10)11(14)9-12(2)17(3,15)16/h10H,4-9H2,1-3H3.
What are the key properties of N-(cyclopropylmethyl)-2-[methyl(methylsulfonyl)amino]-N-propylacetamide?
N-(cyclopropylmethyl)-2-[methyl(methylsulfonyl)amino]-N-propylacetamide has a molecular weight of 262.37 g/mol, XLogP of 0.53, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-2-[methyl(methylsulfonyl)amino]-N-propylacetamide is sourced from PubChem (CID 86929554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).