1-(hydroxymethyl)-2-[(sulfamoylamino)methyl]cyclopentane

C7H16N2O3S — CID 112573821

IUPAC1-(hydroxymethyl)-2-[(sulfamoylamino)methyl]cyclopentane
SMILESNS(=O)(=O)NCC1CCCC1CO
InChIInChI=1S/C7H16N2O3S/c8-13(11,12)9-4-6-2-1-3-7(6)5-10/h6-7,9-10H,1-5H2,(H2,8,11,12)
InChIKeyLUXFMSVNWLLOTN-UHFFFAOYSA-N
MW208.28 g/mol
LogP-0.81
Rot. Bonds4

About 1-(hydroxymethyl)-2-[(sulfamoylamino)methyl]cyclopentane

1-(hydroxymethyl)-2-[(sulfamoylamino)methyl]cyclopentane (PubChem CID 112573821) has the molecular formula C7H16N2O3S and a molecular weight of 208.28 g/mol. Its IUPAC name is 1-(hydroxymethyl)-2-[(sulfamoylamino)methyl]cyclopentane.

Molecular Properties

Compound Name1-(hydroxymethyl)-2-[(sulfamoylamino)methyl]cyclopentane
PubChem CID112573821
Molecular FormulaC7H16N2O3S
Molecular Weight208.28 g/mol
Exact Mass208.09
IUPAC Name1-(hydroxymethyl)-2-[(sulfamoylamino)methyl]cyclopentane
SMILESNS(=O)(=O)NCC1CCCC1CO
InChIInChI=1S/C7H16N2O3S/c8-13(11,12)9-4-6-2-1-3-7(6)5-10/h6-7,9-10H,1-5H2,(H2,8,11,12)
InChIKeyLUXFMSVNWLLOTN-UHFFFAOYSA-N
XLogP-0.81
TPSA92.42 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.28
LogP ≤ 5-0.81
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(hydroxymethyl)-2-[(sulfamoylamino)methyl]cyclopentane?
The IUPAC name of 1-(hydroxymethyl)-2-[(sulfamoylamino)methyl]cyclopentane (CID 112573821) is 1-(hydroxymethyl)-2-[(sulfamoylamino)methyl]cyclopentane.
What is the SMILES notation for 1-(hydroxymethyl)-2-[(sulfamoylamino)methyl]cyclopentane?
The canonical SMILES for 1-(hydroxymethyl)-2-[(sulfamoylamino)methyl]cyclopentane is NS(=O)(=O)NCC1CCCC1CO.
What is the InChIKey of 1-(hydroxymethyl)-2-[(sulfamoylamino)methyl]cyclopentane?
The InChIKey is LUXFMSVNWLLOTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O3S/c8-13(11,12)9-4-6-2-1-3-7(6)5-10/h6-7,9-10H,1-5H2,(H2,8,11,12).
What are the key properties of 1-(hydroxymethyl)-2-[(sulfamoylamino)methyl]cyclopentane?
1-(hydroxymethyl)-2-[(sulfamoylamino)methyl]cyclopentane has a molecular weight of 208.28 g/mol, XLogP of -0.81, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(hydroxymethyl)-2-[(sulfamoylamino)methyl]cyclopentane is sourced from PubChem (CID 112573821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).