1-cyclopentyl-N-[2-[(3R)-oxan-3-yl]ethyl]methanesulfonamide

C13H25NO3S — CID 164642162

IUPAC1-cyclopentyl-N-[2-[(3R)-oxan-3-yl]ethyl]methanesulfonamide
SMILESO=S(=O)(CC1CCCC1)NCC[C@H]1CCCOC1
InChIInChI=1S/C13H25NO3S/c15-18(16,11-13-4-1-2-5-13)14-8-7-12-6-3-9-17-10-12/h12-14H,1-11H2/t12-/m1/s1
InChIKeyWDMORTGYVXCJFG-GFCCVEGCSA-N
MW275.41 g/mol
LogP1.91
Rot. Bonds6

About 1-cyclopentyl-N-[2-[(3R)-oxan-3-yl]ethyl]methanesulfonamide

1-cyclopentyl-N-[2-[(3R)-oxan-3-yl]ethyl]methanesulfonamide (PubChem CID 164642162) has the molecular formula C13H25NO3S and a molecular weight of 275.41 g/mol. Its IUPAC name is 1-cyclopentyl-N-[2-[(3R)-oxan-3-yl]ethyl]methanesulfonamide.

Molecular Properties

Compound Name1-cyclopentyl-N-[2-[(3R)-oxan-3-yl]ethyl]methanesulfonamide
PubChem CID164642162
Molecular FormulaC13H25NO3S
Molecular Weight275.41 g/mol
Exact Mass275.16
IUPAC Name1-cyclopentyl-N-[2-[(3R)-oxan-3-yl]ethyl]methanesulfonamide
SMILESO=S(=O)(CC1CCCC1)NCC[C@H]1CCCOC1
InChIInChI=1S/C13H25NO3S/c15-18(16,11-13-4-1-2-5-13)14-8-7-12-6-3-9-17-10-12/h12-14H,1-11H2/t12-/m1/s1
InChIKeyWDMORTGYVXCJFG-GFCCVEGCSA-N
XLogP1.91
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.41
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-cyclopentyl-2,2,2-trifluoroethyl)-1-(oxan-4-yl)methanesulfonamide
CID 75438943
3-Amino-3-(oxan-4-yl)propane-1-sulfonyl fluoride
CID 165565355
N-(cyclopentylmethyl)-2-methoxyethanesulfonamide
CID 110307531
N-(5-methylhexyl)oxane-4-sulfonamide
CID 172505553
N-[1-(aminomethyl)cyclopentyl]oxane-4-sulfonamide
CID 62047875
N-(oxan-4-ylmethyl)ethanesulfonamide
CID 62351914
N-(oxan-4-ylmethyl)propane-2-sulfonamide
CID 62351915
N-(oxan-4-ylmethyl)propane-1-sulfonamide
CID 62351916
N-[2-(aminomethyl)cyclopentyl]oxane-4-sulfonamide
CID 62955864
3-amino-N-(oxan-4-ylmethyl)propane-1-sulfonamide
CID 63712454
2-amino-N-(oxan-4-ylmethyl)ethanesulfonamide
CID 63713483
4-amino-N-(oxan-4-ylmethyl)butane-1-sulfonamide
CID 63713484

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-N-[2-[(3R)-oxan-3-yl]ethyl]methanesulfonamide?
The IUPAC name of 1-cyclopentyl-N-[2-[(3R)-oxan-3-yl]ethyl]methanesulfonamide (CID 164642162) is 1-cyclopentyl-N-[2-[(3R)-oxan-3-yl]ethyl]methanesulfonamide.
What is the SMILES notation for 1-cyclopentyl-N-[2-[(3R)-oxan-3-yl]ethyl]methanesulfonamide?
The canonical SMILES for 1-cyclopentyl-N-[2-[(3R)-oxan-3-yl]ethyl]methanesulfonamide is O=S(=O)(CC1CCCC1)NCC[C@H]1CCCOC1.
What is the InChIKey of 1-cyclopentyl-N-[2-[(3R)-oxan-3-yl]ethyl]methanesulfonamide?
The InChIKey is WDMORTGYVXCJFG-GFCCVEGCSA-N. The full InChI is InChI=1S/C13H25NO3S/c15-18(16,11-13-4-1-2-5-13)14-8-7-12-6-3-9-17-10-12/h12-14H,1-11H2/t12-/m1/s1.
What are the key properties of 1-cyclopentyl-N-[2-[(3R)-oxan-3-yl]ethyl]methanesulfonamide?
1-cyclopentyl-N-[2-[(3R)-oxan-3-yl]ethyl]methanesulfonamide has a molecular weight of 275.41 g/mol, XLogP of 1.91, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-N-[2-[(3R)-oxan-3-yl]ethyl]methanesulfonamide is sourced from PubChem (CID 164642162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).