N-[1-(aminomethyl)cyclopentyl]ethanesulfonamide

C8H18N2O2S — CID 28940534

IUPACN-[1-(aminomethyl)cyclopentyl]ethanesulfonamide
SMILESCCS(=O)(=O)NC1(CN)CCCC1
InChIInChI=1S/C8H18N2O2S/c1-2-13(11,12)10-8(7-9)5-3-4-6-8/h10H,2-7,9H2,1H3
InChIKeyRXRVRLBZHWOQKJ-UHFFFAOYSA-N
MW206.31 g/mol
LogP0.20
Rot. Bonds4

About N-[1-(aminomethyl)cyclopentyl]ethanesulfonamide

N-[1-(aminomethyl)cyclopentyl]ethanesulfonamide (PubChem CID 28940534) has the molecular formula C8H18N2O2S and a molecular weight of 206.31 g/mol. Its IUPAC name is N-[1-(aminomethyl)cyclopentyl]ethanesulfonamide.

Molecular Properties

Compound NameN-[1-(aminomethyl)cyclopentyl]ethanesulfonamide
PubChem CID28940534
Molecular FormulaC8H18N2O2S
Molecular Weight206.31 g/mol
Exact Mass206.11
IUPAC NameN-[1-(aminomethyl)cyclopentyl]ethanesulfonamide
SMILESCCS(=O)(=O)NC1(CN)CCCC1
InChIInChI=1S/C8H18N2O2S/c1-2-13(11,12)10-8(7-9)5-3-4-6-8/h10H,2-7,9H2,1H3
InChIKeyRXRVRLBZHWOQKJ-UHFFFAOYSA-N
XLogP0.20
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.31
LogP ≤ 50.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[1-(aminomethyl)cyclopentyl]ethanesulfonamide?
The IUPAC name of N-[1-(aminomethyl)cyclopentyl]ethanesulfonamide (CID 28940534) is N-[1-(aminomethyl)cyclopentyl]ethanesulfonamide.
What is the SMILES notation for N-[1-(aminomethyl)cyclopentyl]ethanesulfonamide?
The canonical SMILES for N-[1-(aminomethyl)cyclopentyl]ethanesulfonamide is CCS(=O)(=O)NC1(CN)CCCC1.
What is the InChIKey of N-[1-(aminomethyl)cyclopentyl]ethanesulfonamide?
The InChIKey is RXRVRLBZHWOQKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O2S/c1-2-13(11,12)10-8(7-9)5-3-4-6-8/h10H,2-7,9H2,1H3.
What are the key properties of N-[1-(aminomethyl)cyclopentyl]ethanesulfonamide?
N-[1-(aminomethyl)cyclopentyl]ethanesulfonamide has a molecular weight of 206.31 g/mol, XLogP of 0.20, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(aminomethyl)cyclopentyl]ethanesulfonamide is sourced from PubChem (CID 28940534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).