2-(methylsulfamoylamino)cycloheptan-1-ol

C8H18N2O3S — CID 114809764

IUPAC2-(methylsulfamoylamino)cycloheptan-1-ol
SMILESCNS(=O)(=O)NC1CCCCCC1O
InChIInChI=1S/C8H18N2O3S/c1-9-14(12,13)10-7-5-3-2-4-6-8(7)11/h7-11H,2-6H2,1H3
InChIKeyCLQIIYOWWLOVLE-UHFFFAOYSA-N
MW222.31 g/mol
LogP-0.27
Rot. Bonds3

About 2-(methylsulfamoylamino)cycloheptan-1-ol

2-(methylsulfamoylamino)cycloheptan-1-ol (PubChem CID 114809764) has the molecular formula C8H18N2O3S and a molecular weight of 222.31 g/mol. Its IUPAC name is 2-(methylsulfamoylamino)cycloheptan-1-ol.

Molecular Properties

Compound Name2-(methylsulfamoylamino)cycloheptan-1-ol
PubChem CID114809764
Molecular FormulaC8H18N2O3S
Molecular Weight222.31 g/mol
Exact Mass222.10
IUPAC Name2-(methylsulfamoylamino)cycloheptan-1-ol
SMILESCNS(=O)(=O)NC1CCCCCC1O
InChIInChI=1S/C8H18N2O3S/c1-9-14(12,13)10-7-5-3-2-4-6-8(7)11/h7-11H,2-6H2,1H3
InChIKeyCLQIIYOWWLOVLE-UHFFFAOYSA-N
XLogP-0.27
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.31
LogP ≤ 5-0.27
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

trans-(1S,2S)-1-[[cyclohexyl(methyl)sulfamoyl]amino]-2-hydroxycyclohexane
CID 94415076
cis-(1R,2S)-2-(methylamino)cyclononan-1-ol
CID 138485260
trans-(1R,2R)-2-(2-methoxyethylsulfamoylamino)cyclohexan-1-ol
CID 102739274
1-chloro-N-[(1R,2R)-2-hydroxycyclohexyl]methanesulfonamide
CID 107858977
1-cyclopropyl-N-[(1S,2S)-2-hydroxycyclohexyl]methanesulfonamide
CID 104953228
1-amino-N-(2-hydroxycycloheptyl)butane-2-sulfonamide
CID 113394692
N-[(1S,2S)-2-hydroxycyclohexyl]-4-methylsulfonylbenzenesulfonamide
CID 104953140
2-chloro-N-[(1S,2S)-2-hydroxycyclohexyl]ethanesulfonamide
CID 107858968
2-[[(1S,2S)-2-hydroxycyclohexyl]amino]cycloheptan-1-ol
CID 102731599
N-[(1R,2R)-2-hydroxycyclohexyl]-2-methylpiperidine-1-sulfonamide
CID 104922367
N-[(1S,2S)-2-hydroxycyclohexyl]-2,4,6-trimethylbenzenesulfonamide
CID 104953218
N-(2-hydroxycyclohexyl)oxane-4-sulfonamide
CID 55064030

Frequently Asked Questions

What is the IUPAC name of 2-(methylsulfamoylamino)cycloheptan-1-ol?
The IUPAC name of 2-(methylsulfamoylamino)cycloheptan-1-ol (CID 114809764) is 2-(methylsulfamoylamino)cycloheptan-1-ol.
What is the SMILES notation for 2-(methylsulfamoylamino)cycloheptan-1-ol?
The canonical SMILES for 2-(methylsulfamoylamino)cycloheptan-1-ol is CNS(=O)(=O)NC1CCCCCC1O.
What is the InChIKey of 2-(methylsulfamoylamino)cycloheptan-1-ol?
The InChIKey is CLQIIYOWWLOVLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O3S/c1-9-14(12,13)10-7-5-3-2-4-6-8(7)11/h7-11H,2-6H2,1H3.
What are the key properties of 2-(methylsulfamoylamino)cycloheptan-1-ol?
2-(methylsulfamoylamino)cycloheptan-1-ol has a molecular weight of 222.31 g/mol, XLogP of -0.27, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylsulfamoylamino)cycloheptan-1-ol is sourced from PubChem (CID 114809764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).