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

C15H28N2O3S — CID 113148899

IUPACN-cycloheptyl-2-[cyclopentyl(methylsulfonyl)amino]acetamide
SMILESCS(=O)(=O)N(CC(=O)NC1CCCCCC1)C1CCCC1
InChIInChI=1S/C15H28N2O3S/c1-21(19,20)17(14-10-6-7-11-14)12-15(18)16-13-8-4-2-3-5-9-13/h13-14H,2-12H2,1H3,(H,16,18)
InChIKeyJNRVRFOHJBMXQN-UHFFFAOYSA-N
MW316.47 g/mol
LogP2.03
Rot. Bonds5

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

N-cycloheptyl-2-[cyclopentyl(methylsulfonyl)amino]acetamide (PubChem CID 113148899) has the molecular formula C15H28N2O3S and a molecular weight of 316.47 g/mol. Its IUPAC name is N-cycloheptyl-2-[cyclopentyl(methylsulfonyl)amino]acetamide.

Molecular Properties

Compound NameN-cycloheptyl-2-[cyclopentyl(methylsulfonyl)amino]acetamide
PubChem CID113148899
Molecular FormulaC15H28N2O3S
Molecular Weight316.47 g/mol
Exact Mass316.18
IUPAC NameN-cycloheptyl-2-[cyclopentyl(methylsulfonyl)amino]acetamide
SMILESCS(=O)(=O)N(CC(=O)NC1CCCCCC1)C1CCCC1
InChIInChI=1S/C15H28N2O3S/c1-21(19,20)17(14-10-6-7-11-14)12-15(18)16-13-8-4-2-3-5-9-13/h13-14H,2-12H2,1H3,(H,16,18)
InChIKeyJNRVRFOHJBMXQN-UHFFFAOYSA-N
XLogP2.03
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.47
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[cyclohexyl(methylsulfonyl)amino]-N-cyclooctylacetamide
CID 2986754
N-cyclohexyl-3-[cyclopropyl(methylsulfonyl)amino]propanamide
CID 113136251
1-cyclohexyl-3-[2-[cyclopentyl(methylsulfonyl)amino]ethyl]urea
CID 113065748
2-[cyclopentyl(methylsulfonyl)amino]-N-(2-methoxyethyl)acetamide
CID 113148836
1-cyclohexyl-3-[2-[cyclopropyl(methylsulfonyl)amino]ethyl]urea
CID 113065144
2-[cycloheptyl(methylsulfonyl)amino]-N-(4-methylphenyl)acetamide
CID 113153101
2-[cyclohexyl(methylsulfonyl)amino]-N-(4-fluorophenyl)acetamide
CID 2111492
2-[cyclohexyl(methylsulfonyl)amino]-N-(2,5-dichlorophenyl)acetamide
CID 1021971
N-[2-(azepan-1-yl)-2-oxoethyl]-N-cycloheptylmethanesulfonamide
CID 113153097
N-cyclohexyl-3-[(1,1-dioxothiolan-3-yl)-methylsulfonylamino]propanamide
CID 113140503
2-[cycloheptyl(methylsulfonyl)amino]-N-(2-methylphenyl)acetamide
CID 113153099
2-[cycloheptyl(methylsulfonyl)amino]-N-(pyridin-2-ylmethyl)acetamide
CID 113153062

Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-2-[cyclopentyl(methylsulfonyl)amino]acetamide?
The IUPAC name of N-cycloheptyl-2-[cyclopentyl(methylsulfonyl)amino]acetamide (CID 113148899) is N-cycloheptyl-2-[cyclopentyl(methylsulfonyl)amino]acetamide.
What is the SMILES notation for N-cycloheptyl-2-[cyclopentyl(methylsulfonyl)amino]acetamide?
The canonical SMILES for N-cycloheptyl-2-[cyclopentyl(methylsulfonyl)amino]acetamide is CS(=O)(=O)N(CC(=O)NC1CCCCCC1)C1CCCC1.
What is the InChIKey of N-cycloheptyl-2-[cyclopentyl(methylsulfonyl)amino]acetamide?
The InChIKey is JNRVRFOHJBMXQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O3S/c1-21(19,20)17(14-10-6-7-11-14)12-15(18)16-13-8-4-2-3-5-9-13/h13-14H,2-12H2,1H3,(H,16,18).
What are the key properties of N-cycloheptyl-2-[cyclopentyl(methylsulfonyl)amino]acetamide?
N-cycloheptyl-2-[cyclopentyl(methylsulfonyl)amino]acetamide has a molecular weight of 316.47 g/mol, XLogP of 2.03, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-2-[cyclopentyl(methylsulfonyl)amino]acetamide is sourced from PubChem (CID 113148899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).