2-[cyclopentyl(methylsulfonyl)amino]-N-(2-methoxyethyl)acetamide

C11H22N2O4S — CID 113148836

IUPAC2-[cyclopentyl(methylsulfonyl)amino]-N-(2-methoxyethyl)acetamide
SMILESCOCCNC(=O)CN(C1CCCC1)S(C)(=O)=O
InChIInChI=1S/C11H22N2O4S/c1-17-8-7-12-11(14)9-13(18(2,15)16)10-5-3-4-6-10/h10H,3-9H2,1-2H3,(H,12,14)
InChIKeyHALMKWLYAPDHIU-UHFFFAOYSA-N
MW278.37 g/mol
LogP-0.05
Rot. Bonds7

About 2-[cyclopentyl(methylsulfonyl)amino]-N-(2-methoxyethyl)acetamide

2-[cyclopentyl(methylsulfonyl)amino]-N-(2-methoxyethyl)acetamide (PubChem CID 113148836) has the molecular formula C11H22N2O4S and a molecular weight of 278.37 g/mol. Its IUPAC name is 2-[cyclopentyl(methylsulfonyl)amino]-N-(2-methoxyethyl)acetamide.

Molecular Properties

Compound Name2-[cyclopentyl(methylsulfonyl)amino]-N-(2-methoxyethyl)acetamide
PubChem CID113148836
Molecular FormulaC11H22N2O4S
Molecular Weight278.37 g/mol
Exact Mass278.13
IUPAC Name2-[cyclopentyl(methylsulfonyl)amino]-N-(2-methoxyethyl)acetamide
SMILESCOCCNC(=O)CN(C1CCCC1)S(C)(=O)=O
InChIInChI=1S/C11H22N2O4S/c1-17-8-7-12-11(14)9-13(18(2,15)16)10-5-3-4-6-10/h10H,3-9H2,1-2H3,(H,12,14)
InChIKeyHALMKWLYAPDHIU-UHFFFAOYSA-N
XLogP-0.05
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.37
LogP ≤ 5-0.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[cycloheptyl(methylsulfonyl)amino]-N-[2-(4-methoxyphenoxy)ethyl]acetamide
CID 113153086
2-[cyclohexyl-[2-(2-methoxyethylamino)-2-oxoethyl]amino]-N-(2-methoxyethyl)acetamide
CID 43067877
2-[acetyl(cyclohexyl)amino]-N-(2-methoxyethyl)acetamide
CID 113159416
2-[cyclopentyl(2-hydroxyethyl)amino]-N-(2-methoxyethyl)acetamide
CID 62016627
2-[cyclopropyl(methylsulfonyl)amino]-N-(3-methylbutyl)acetamide
CID 113147921
2-[cyclohexyl(methylsulfonyl)amino]-N-cyclooctylacetamide
CID 2986754
N-cycloheptyl-2-[cyclopentyl(methylsulfonyl)amino]acetamide
CID 113148899
2-[2-aminoethyl(cyclobutyl)amino]-N-(2-methoxyethyl)acetamide
CID 102875295
2-[acetyl(cyclohexyl)amino]-N-(3-methoxypropyl)acetamide
CID 113159417
N-[(4-chlorophenyl)methyl]-2-[cyclohexyl(methylsulfonyl)amino]acetamide
CID 989289
2-[cycloheptyl(methylsulfonyl)amino]-N-[(4-fluorophenyl)methyl]acetamide
CID 113153055
methyl 4-[[2-[cyclopentyl(methylsulfonyl)amino]acetyl]amino]benzoate
CID 113148971

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopentyl(methylsulfonyl)amino]-N-(2-methoxyethyl)acetamide?
The IUPAC name of 2-[cyclopentyl(methylsulfonyl)amino]-N-(2-methoxyethyl)acetamide (CID 113148836) is 2-[cyclopentyl(methylsulfonyl)amino]-N-(2-methoxyethyl)acetamide.
What is the SMILES notation for 2-[cyclopentyl(methylsulfonyl)amino]-N-(2-methoxyethyl)acetamide?
The canonical SMILES for 2-[cyclopentyl(methylsulfonyl)amino]-N-(2-methoxyethyl)acetamide is COCCNC(=O)CN(C1CCCC1)S(C)(=O)=O.
What is the InChIKey of 2-[cyclopentyl(methylsulfonyl)amino]-N-(2-methoxyethyl)acetamide?
The InChIKey is HALMKWLYAPDHIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O4S/c1-17-8-7-12-11(14)9-13(18(2,15)16)10-5-3-4-6-10/h10H,3-9H2,1-2H3,(H,12,14).
What are the key properties of 2-[cyclopentyl(methylsulfonyl)amino]-N-(2-methoxyethyl)acetamide?
2-[cyclopentyl(methylsulfonyl)amino]-N-(2-methoxyethyl)acetamide has a molecular weight of 278.37 g/mol, XLogP of -0.05, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopentyl(methylsulfonyl)amino]-N-(2-methoxyethyl)acetamide is sourced from PubChem (CID 113148836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).