N-carbamoyl-N-cyclohexylsulfamoyl chloride

C7H13ClN2O3S — CID 172847013

IUPACN-carbamoyl-N-cyclohexylsulfamoyl chloride
SMILESNC(=O)N(C1CCCCC1)S(=O)(=O)Cl
InChIInChI=1S/C7H13ClN2O3S/c8-14(12,13)10(7(9)11)6-4-2-1-3-5-6/h6H,1-5H2,(H2,9,11)
InChIKeyXOEHQAUGLWXHCH-UHFFFAOYSA-N
MW240.71 g/mol
LogP1.18
Rot. Bonds2

About N-carbamoyl-N-cyclohexylsulfamoyl chloride

N-carbamoyl-N-cyclohexylsulfamoyl chloride (PubChem CID 172847013) has the molecular formula C7H13ClN2O3S and a molecular weight of 240.71 g/mol. Its IUPAC name is N-carbamoyl-N-cyclohexylsulfamoyl chloride.

Molecular Properties

Compound NameN-carbamoyl-N-cyclohexylsulfamoyl chloride
PubChem CID172847013
Molecular FormulaC7H13ClN2O3S
Molecular Weight240.71 g/mol
Exact Mass240.03
IUPAC NameN-carbamoyl-N-cyclohexylsulfamoyl chloride
SMILESNC(=O)N(C1CCCCC1)S(=O)(=O)Cl
InChIInChI=1S/C7H13ClN2O3S/c8-14(12,13)10(7(9)11)6-4-2-1-3-5-6/h6H,1-5H2,(H2,9,11)
InChIKeyXOEHQAUGLWXHCH-UHFFFAOYSA-N
XLogP1.18
TPSA80.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.71
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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1-carbamothioyl-1-cyclohexylurea
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[(2S)-2-aminopropanoyl]-cyclohexylsulfamic acid
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N-cyclohexyl-N-ethylsulfamoyl chloride
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carbonochloridoyl(cyclohexyl)carbamic acid
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1-(4-chlorophenyl)-1-cyclohexylurea
CID 68800466
2-[amino(cyclohexyl)amino]-2-oxoacetamide;hydrochloride
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2-[cyclohexyl(methyl)amino]acetamide
CID 22200523
2-[2-chloroethylsulfonyl(cyclopentyl)amino]acetamide
CID 107651092
N-cyclohexylacetohydrazide
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1-cyclohexyl-1-[(3R)-oxolan-3-yl]urea
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2-[2-chloroprop-2-enylsulfonyl(cyclopentyl)amino]acetamide
CID 91652020

Frequently Asked Questions

What is the IUPAC name of N-carbamoyl-N-cyclohexylsulfamoyl chloride?
The IUPAC name of N-carbamoyl-N-cyclohexylsulfamoyl chloride (CID 172847013) is N-carbamoyl-N-cyclohexylsulfamoyl chloride.
What is the SMILES notation for N-carbamoyl-N-cyclohexylsulfamoyl chloride?
The canonical SMILES for N-carbamoyl-N-cyclohexylsulfamoyl chloride is NC(=O)N(C1CCCCC1)S(=O)(=O)Cl.
What is the InChIKey of N-carbamoyl-N-cyclohexylsulfamoyl chloride?
The InChIKey is XOEHQAUGLWXHCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13ClN2O3S/c8-14(12,13)10(7(9)11)6-4-2-1-3-5-6/h6H,1-5H2,(H2,9,11).
What are the key properties of N-carbamoyl-N-cyclohexylsulfamoyl chloride?
N-carbamoyl-N-cyclohexylsulfamoyl chloride has a molecular weight of 240.71 g/mol, XLogP of 1.18, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-carbamoyl-N-cyclohexylsulfamoyl chloride is sourced from PubChem (CID 172847013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).