2-(cyclopentylamino)-N-(3-methylsulfonylpropyl)acetamide

C11H22N2O3S — CID 54904868

IUPAC2-(cyclopentylamino)-N-(3-methylsulfonylpropyl)acetamide
SMILESCS(=O)(=O)CCCNC(=O)CNC1CCCC1
InChIInChI=1S/C11H22N2O3S/c1-17(15,16)8-4-7-12-11(14)9-13-10-5-2-3-6-10/h10,13H,2-9H2,1H3,(H,12,14)
InChIKeyIGNZWWSAGDVCSI-UHFFFAOYSA-N
MW262.37 g/mol
LogP0.07
Rot. Bonds7

About 2-(cyclopentylamino)-N-(3-methylsulfonylpropyl)acetamide

2-(cyclopentylamino)-N-(3-methylsulfonylpropyl)acetamide (PubChem CID 54904868) has the molecular formula C11H22N2O3S and a molecular weight of 262.37 g/mol. Its IUPAC name is 2-(cyclopentylamino)-N-(3-methylsulfonylpropyl)acetamide.

Molecular Properties

Compound Name2-(cyclopentylamino)-N-(3-methylsulfonylpropyl)acetamide
PubChem CID54904868
Molecular FormulaC11H22N2O3S
Molecular Weight262.37 g/mol
Exact Mass262.14
IUPAC Name2-(cyclopentylamino)-N-(3-methylsulfonylpropyl)acetamide
SMILESCS(=O)(=O)CCCNC(=O)CNC1CCCC1
InChIInChI=1S/C11H22N2O3S/c1-17(15,16)8-4-7-12-11(14)9-13-10-5-2-3-6-10/h10,13H,2-9H2,1H3,(H,12,14)
InChIKeyIGNZWWSAGDVCSI-UHFFFAOYSA-N
XLogP0.07
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.37
LogP ≤ 50.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(cyclopentylamino)-N-(2-sulfamoylethyl)acetamide
CID 60848544
1-cyclobutyl-3-(3-methylsulfonylpropyl)urea
CID 115617843
N-(3-butoxypropyl)-2-(cyclopentylamino)acetamide
CID 113219331
N-butyl-2-(cyclopropylamino)acetamide
CID 54773122
N-[2-[[2-(cyclopentylamino)acetyl]amino]ethyl]-2-methylpropanamide
CID 61248306
2-(cyclopropylamino)-N-(3-pyrrolidin-1-ylpropyl)acetamide
CID 60843562
2-(cyclododecylamino)-N-ethylacetamide
CID 43399943
2-(cyclooctylamino)-N-ethylacetamide
CID 28575760
2-chloro-N-(3-methylsulfonylpropyl)acetamide
CID 61019975
2-(cyclopentylamino)-N-(2,3,3-trimethylbutyl)acetamide
CID 83142014
1-cyclohexyl-2-methyl-3-(3-methylsulfonylpropyl)guanidine
CID 110958583
2-(cyclopentylamino)-N-(3-ethenoxypropyl)acetamide
CID 61273703

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopentylamino)-N-(3-methylsulfonylpropyl)acetamide?
The IUPAC name of 2-(cyclopentylamino)-N-(3-methylsulfonylpropyl)acetamide (CID 54904868) is 2-(cyclopentylamino)-N-(3-methylsulfonylpropyl)acetamide.
What is the SMILES notation for 2-(cyclopentylamino)-N-(3-methylsulfonylpropyl)acetamide?
The canonical SMILES for 2-(cyclopentylamino)-N-(3-methylsulfonylpropyl)acetamide is CS(=O)(=O)CCCNC(=O)CNC1CCCC1.
What is the InChIKey of 2-(cyclopentylamino)-N-(3-methylsulfonylpropyl)acetamide?
The InChIKey is IGNZWWSAGDVCSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O3S/c1-17(15,16)8-4-7-12-11(14)9-13-10-5-2-3-6-10/h10,13H,2-9H2,1H3,(H,12,14).
What are the key properties of 2-(cyclopentylamino)-N-(3-methylsulfonylpropyl)acetamide?
2-(cyclopentylamino)-N-(3-methylsulfonylpropyl)acetamide has a molecular weight of 262.37 g/mol, XLogP of 0.07, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopentylamino)-N-(3-methylsulfonylpropyl)acetamide is sourced from PubChem (CID 54904868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).