N-[(3-aminocyclopentyl)methyl]-1-(oxolan-2-yl)methanesulfonamide

C11H22N2O3S — CID 114146773

IUPACN-[(3-aminocyclopentyl)methyl]-1-(oxolan-2-yl)methanesulfonamide
SMILESNC1CCC(CNS(=O)(=O)CC2CCCO2)C1
InChIInChI=1S/C11H22N2O3S/c12-10-4-3-9(6-10)7-13-17(14,15)8-11-2-1-5-16-11/h9-11,13H,1-8,12H2
InChIKeyNSZPXZHSRRKBNV-UHFFFAOYSA-N
MW262.37 g/mol
LogP0.21
Rot. Bonds5

About N-[(3-aminocyclopentyl)methyl]-1-(oxolan-2-yl)methanesulfonamide

N-[(3-aminocyclopentyl)methyl]-1-(oxolan-2-yl)methanesulfonamide (PubChem CID 114146773) has the molecular formula C11H22N2O3S and a molecular weight of 262.37 g/mol. Its IUPAC name is N-[(3-aminocyclopentyl)methyl]-1-(oxolan-2-yl)methanesulfonamide.

Molecular Properties

Compound NameN-[(3-aminocyclopentyl)methyl]-1-(oxolan-2-yl)methanesulfonamide
PubChem CID114146773
Molecular FormulaC11H22N2O3S
Molecular Weight262.37 g/mol
Exact Mass262.14
IUPAC NameN-[(3-aminocyclopentyl)methyl]-1-(oxolan-2-yl)methanesulfonamide
SMILESNC1CCC(CNS(=O)(=O)CC2CCCO2)C1
InChIInChI=1S/C11H22N2O3S/c12-10-4-3-9(6-10)7-13-17(14,15)8-11-2-1-5-16-11/h9-11,13H,1-8,12H2
InChIKeyNSZPXZHSRRKBNV-UHFFFAOYSA-N
XLogP0.21
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.37
LogP ≤ 50.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(4-aminocyclohexyl)methyl]-1-(oxolan-2-yl)methanesulfonamide
CID 106126336
N-(2-aminoethyl)-1-(oxolan-2-yl)methanesulfonamide;hydrochloride
CID 119960022
1-(oxan-2-yl)-N-(pyrrolidin-3-ylmethyl)methanesulfonamide
CID 120721075
1-(oxolan-2-yl)-N-(pyrrolidin-2-ylmethyl)methanesulfonamide;hydrochloride
CID 119974117
N-(2-ethylbutyl)-1-(oxolan-2-yl)methanesulfonamide
CID 115613323
N-(4-aminobutyl)-1-(oxolan-2-yl)methanesulfonamide
CID 63246284
2-(oxolan-2-ylmethylsulfonylamino)acetic acid
CID 63246701
N-(3-aminocyclobutyl)-1-(oxan-2-yl)methanesulfonamide;hydrochloride
CID 120663977
N-(3-hydroxypropyl)-1-(oxolan-2-yl)methanesulfonamide
CID 63247384
N-[2-(methylamino)ethyl]-1-(oxolan-2-yl)methanesulfonamide;hydrochloride
CID 119972933
N-[(1-aminocyclohexyl)methyl]-1-(oxolan-2-yl)methanesulfonamide
CID 63247002
N-(3-chloro-2-methylpropyl)-1-(oxolan-2-yl)methanesulfonamide
CID 65037518

Frequently Asked Questions

What is the IUPAC name of N-[(3-aminocyclopentyl)methyl]-1-(oxolan-2-yl)methanesulfonamide?
The IUPAC name of N-[(3-aminocyclopentyl)methyl]-1-(oxolan-2-yl)methanesulfonamide (CID 114146773) is N-[(3-aminocyclopentyl)methyl]-1-(oxolan-2-yl)methanesulfonamide.
What is the SMILES notation for N-[(3-aminocyclopentyl)methyl]-1-(oxolan-2-yl)methanesulfonamide?
The canonical SMILES for N-[(3-aminocyclopentyl)methyl]-1-(oxolan-2-yl)methanesulfonamide is NC1CCC(CNS(=O)(=O)CC2CCCO2)C1.
What is the InChIKey of N-[(3-aminocyclopentyl)methyl]-1-(oxolan-2-yl)methanesulfonamide?
The InChIKey is NSZPXZHSRRKBNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O3S/c12-10-4-3-9(6-10)7-13-17(14,15)8-11-2-1-5-16-11/h9-11,13H,1-8,12H2.
What are the key properties of N-[(3-aminocyclopentyl)methyl]-1-(oxolan-2-yl)methanesulfonamide?
N-[(3-aminocyclopentyl)methyl]-1-(oxolan-2-yl)methanesulfonamide has a molecular weight of 262.37 g/mol, XLogP of 0.21, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-aminocyclopentyl)methyl]-1-(oxolan-2-yl)methanesulfonamide is sourced from PubChem (CID 114146773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).