1-[(dipropylsulfamoylamino)methyl]-2-hydroxycyclohexane

C13H28N2O3S — CID 64912245

IUPAC1-[(dipropylsulfamoylamino)methyl]-2-hydroxycyclohexane
SMILESCCCN(CCC)S(=O)(=O)NCC1CCCCC1O
InChIInChI=1S/C13H28N2O3S/c1-3-9-15(10-4-2)19(17,18)14-11-12-7-5-6-8-13(12)16/h12-14,16H,3-11H2,1-2H3
InChIKeyYJUFAIMGXFEXJJ-UHFFFAOYSA-N
MW292.44 g/mol
LogP1.49
Rot. Bonds8

About 1-[(dipropylsulfamoylamino)methyl]-2-hydroxycyclohexane

1-[(dipropylsulfamoylamino)methyl]-2-hydroxycyclohexane (PubChem CID 64912245) has the molecular formula C13H28N2O3S and a molecular weight of 292.44 g/mol. Its IUPAC name is 1-[(dipropylsulfamoylamino)methyl]-2-hydroxycyclohexane.

Molecular Properties

Compound Name1-[(dipropylsulfamoylamino)methyl]-2-hydroxycyclohexane
PubChem CID64912245
Molecular FormulaC13H28N2O3S
Molecular Weight292.44 g/mol
Exact Mass292.18
IUPAC Name1-[(dipropylsulfamoylamino)methyl]-2-hydroxycyclohexane
SMILESCCCN(CCC)S(=O)(=O)NCC1CCCCC1O
InChIInChI=1S/C13H28N2O3S/c1-3-9-15(10-4-2)19(17,18)14-11-12-7-5-6-8-13(12)16/h12-14,16H,3-11H2,1-2H3
InChIKeyYJUFAIMGXFEXJJ-UHFFFAOYSA-N
XLogP1.49
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.44
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

trans-(1S,2S)-1-hydroxy-2-[[[methyl(propyl)sulfamoyl]amino]methyl]cyclopentane
CID 97244865
1-[(dipropylsulfamoylamino)methyl]-3-hydroxycyclohexane
CID 103835757
2-[[(methylsulfonimidoyl)amino]methyl]cyclohexan-1-ol
CID 164656075
N-[(2-hydroxycyclohexyl)methyl]-2-methylsulfonylethanesulfonamide
CID 64911395
1-hydroxy-2-[(sulfamoylamino)methyl]cyclopentane
CID 112695783
3-[(2-hydroxycyclohexyl)methylsulfamoyl]propanoic acid
CID 64929072
N-[(2-hydroxycyclopentyl)methyl]-1-methylsulfonylmethanesulfonamide
CID 82843046
N-[(2-hydroxycyclohexyl)methyl]-2-methoxyethanesulfonamide
CID 64913483
1-[(dipropylsulfamoylamino)methyl]-1-hydroxycycloheptane
CID 65122112
N-[(2-hydroxycyclohexyl)methyl]piperidine-1-sulfonamide
CID 64910982
2-[2-(dipropylsulfamoylamino)ethyl]pyrrolidine
CID 114794083
3-chloro-N-[(2-hydroxycyclohexyl)methyl]propane-1-sulfonamide
CID 64912535

Frequently Asked Questions

What is the IUPAC name of 1-[(dipropylsulfamoylamino)methyl]-2-hydroxycyclohexane?
The IUPAC name of 1-[(dipropylsulfamoylamino)methyl]-2-hydroxycyclohexane (CID 64912245) is 1-[(dipropylsulfamoylamino)methyl]-2-hydroxycyclohexane.
What is the SMILES notation for 1-[(dipropylsulfamoylamino)methyl]-2-hydroxycyclohexane?
The canonical SMILES for 1-[(dipropylsulfamoylamino)methyl]-2-hydroxycyclohexane is CCCN(CCC)S(=O)(=O)NCC1CCCCC1O.
What is the InChIKey of 1-[(dipropylsulfamoylamino)methyl]-2-hydroxycyclohexane?
The InChIKey is YJUFAIMGXFEXJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O3S/c1-3-9-15(10-4-2)19(17,18)14-11-12-7-5-6-8-13(12)16/h12-14,16H,3-11H2,1-2H3.
What are the key properties of 1-[(dipropylsulfamoylamino)methyl]-2-hydroxycyclohexane?
1-[(dipropylsulfamoylamino)methyl]-2-hydroxycyclohexane has a molecular weight of 292.44 g/mol, XLogP of 1.49, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(dipropylsulfamoylamino)methyl]-2-hydroxycyclohexane is sourced from PubChem (CID 64912245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).