(cyclohexylamino) N-cyclohexylsulfamate

C12H24N2O3S — CID 87694019

IUPAC(cyclohexylamino) N-cyclohexylsulfamate
SMILESO=S(=O)(NC1CCCCC1)ONC1CCCCC1
InChIInChI=1S/C12H24N2O3S/c15-18(16,14-12-9-5-2-6-10-12)17-13-11-7-3-1-4-8-11/h11-14H,1-10H2
InChIKeyYKVMSACWYYOAMK-UHFFFAOYSA-N
MW276.40 g/mol
LogP2.01
Rot. Bonds5

About (cyclohexylamino) N-cyclohexylsulfamate

(cyclohexylamino) N-cyclohexylsulfamate (PubChem CID 87694019) has the molecular formula C12H24N2O3S and a molecular weight of 276.40 g/mol. Its IUPAC name is (cyclohexylamino) N-cyclohexylsulfamate.

Molecular Properties

Compound Name(cyclohexylamino) N-cyclohexylsulfamate
PubChem CID87694019
Molecular FormulaC12H24N2O3S
Molecular Weight276.40 g/mol
Exact Mass276.15
IUPAC Name(cyclohexylamino) N-cyclohexylsulfamate
SMILESO=S(=O)(NC1CCCCC1)ONC1CCCCC1
InChIInChI=1S/C12H24N2O3S/c15-18(16,14-12-9-5-2-6-10-12)17-13-11-7-3-1-4-8-11/h11-14H,1-10H2
InChIKeyYKVMSACWYYOAMK-UHFFFAOYSA-N
XLogP2.01
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.40
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-cyclohexylsulfamoyl iodide
CID 155625677
ethyl N-cyclohexylsulfamate
CID 12914623
propan-2-yl N-cyclohexylsulfamate
CID 56638183
N-cycloheptylmethanesulfonamide
CID 3113423
cyclononylsulfamic acid
CID 67135870
cycloheptylsulfamoyl carbamate
CID 87698075
prop-2-ynyl N-cyclohexylsulfamate
CID 123876723
(1-aminocyclohexyl) N-cyclohexylsulfamate
CID 87589048
cyclohexylsulfamic acid;hydrochloride
CID 67875894
calcium N-cyclohexylsulfamate
CID 23616622
calcium bis(N-cyclohexylsulfamate)
CID 8752
CID 68761393
CID 68761393

Frequently Asked Questions

What is the IUPAC name of (cyclohexylamino) N-cyclohexylsulfamate?
The IUPAC name of (cyclohexylamino) N-cyclohexylsulfamate (CID 87694019) is (cyclohexylamino) N-cyclohexylsulfamate.
What is the SMILES notation for (cyclohexylamino) N-cyclohexylsulfamate?
The canonical SMILES for (cyclohexylamino) N-cyclohexylsulfamate is O=S(=O)(NC1CCCCC1)ONC1CCCCC1.
What is the InChIKey of (cyclohexylamino) N-cyclohexylsulfamate?
The InChIKey is YKVMSACWYYOAMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O3S/c15-18(16,14-12-9-5-2-6-10-12)17-13-11-7-3-1-4-8-11/h11-14H,1-10H2.
What are the key properties of (cyclohexylamino) N-cyclohexylsulfamate?
(cyclohexylamino) N-cyclohexylsulfamate has a molecular weight of 276.40 g/mol, XLogP of 2.01, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (cyclohexylamino) N-cyclohexylsulfamate is sourced from PubChem (CID 87694019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).