4-(propan-2-ylsulfamoylamino)cyclohexan-1-ol

C9H20N2O3S — CID 103946865

IUPAC4-(propan-2-ylsulfamoylamino)cyclohexan-1-ol
SMILESCC(C)NS(=O)(=O)NC1CCC(O)CC1
InChIInChI=1S/C9H20N2O3S/c1-7(2)10-15(13,14)11-8-3-5-9(12)6-4-8/h7-12H,3-6H2,1-2H3
InChIKeyMMNIHRXKIKGHRN-UHFFFAOYSA-N
MW236.34 g/mol
LogP0.12
Rot. Bonds4

About 4-(propan-2-ylsulfamoylamino)cyclohexan-1-ol

4-(propan-2-ylsulfamoylamino)cyclohexan-1-ol (PubChem CID 103946865) has the molecular formula C9H20N2O3S and a molecular weight of 236.34 g/mol. Its IUPAC name is 4-(propan-2-ylsulfamoylamino)cyclohexan-1-ol.

Molecular Properties

Compound Name4-(propan-2-ylsulfamoylamino)cyclohexan-1-ol
PubChem CID103946865
Molecular FormulaC9H20N2O3S
Molecular Weight236.34 g/mol
Exact Mass236.12
IUPAC Name4-(propan-2-ylsulfamoylamino)cyclohexan-1-ol
SMILESCC(C)NS(=O)(=O)NC1CCC(O)CC1
InChIInChI=1S/C9H20N2O3S/c1-7(2)10-15(13,14)11-8-3-5-9(12)6-4-8/h7-12H,3-6H2,1-2H3
InChIKeyMMNIHRXKIKGHRN-UHFFFAOYSA-N
XLogP0.12
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.34
LogP ≤ 50.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-(cyclopropylsulfamoylamino)propanoic acid
CID 114805252
3-(cyclopropylsulfamoylamino)butan-2-one
CID 114808600
N-(butan-2-ylsulfamoyl)cyclopropanamine
CID 114383068
(3S)-N-(propan-2-ylsulfamoyl)piperidin-3-amine
CID 104982540
N-(4-hydroxycyclohexyl)-3-methylbutane-1-sulfonamide
CID 63856243
2-(cyclopropylsulfamoylamino)pentan-3-one
CID 114808587
4-N-(cyclopropylsulfamoyl)pentane-2,4-diamine
CID 114812950
3-chloro-N-(4-hydroxycyclohexyl)-2-methylpropane-1-sulfonamide
CID 79586087
4-[(4-hydroxycyclohexyl)amino]-N-propan-2-ylbenzenesulfonamide
CID 43454139
4-(2-methylpropylamino)cyclohexan-1-ol
CID 8024862
2-[(4-hydroxycyclohexyl)amino]-N-propan-2-ylpropanamide
CID 103602120
2-(propan-2-ylsulfamoylamino)cycloheptane-1-carboxylic acid
CID 114806690

Frequently Asked Questions

What is the IUPAC name of 4-(propan-2-ylsulfamoylamino)cyclohexan-1-ol?
The IUPAC name of 4-(propan-2-ylsulfamoylamino)cyclohexan-1-ol (CID 103946865) is 4-(propan-2-ylsulfamoylamino)cyclohexan-1-ol.
What is the SMILES notation for 4-(propan-2-ylsulfamoylamino)cyclohexan-1-ol?
The canonical SMILES for 4-(propan-2-ylsulfamoylamino)cyclohexan-1-ol is CC(C)NS(=O)(=O)NC1CCC(O)CC1.
What is the InChIKey of 4-(propan-2-ylsulfamoylamino)cyclohexan-1-ol?
The InChIKey is MMNIHRXKIKGHRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O3S/c1-7(2)10-15(13,14)11-8-3-5-9(12)6-4-8/h7-12H,3-6H2,1-2H3.
What are the key properties of 4-(propan-2-ylsulfamoylamino)cyclohexan-1-ol?
4-(propan-2-ylsulfamoylamino)cyclohexan-1-ol has a molecular weight of 236.34 g/mol, XLogP of 0.12, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(propan-2-ylsulfamoylamino)cyclohexan-1-ol is sourced from PubChem (CID 103946865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).