(7,7-dimethyl-2-morpholin-4-yl-1-bicyclo[2.2.1]heptanyl)methanesulfonamide

C14H26N2O3S — CID 141440576

IUPAC(7,7-dimethyl-2-morpholin-4-yl-1-bicyclo[2.2.1]heptanyl)methanesulfonamide
SMILESCC1(C)C2CCC1(CS(N)(=O)=O)C(N1CCOCC1)C2
InChIInChI=1S/C14H26N2O3S/c1-13(2)11-3-4-14(13,10-20(15,17)18)12(9-11)16-5-7-19-8-6-16/h11-12H,3-10H2,1-2H3,(H2,15,17,18)
InChIKeyVMYORVHQDJEBSA-UHFFFAOYSA-N
MW302.44 g/mol
LogP0.80
Rot. Bonds3

About (7,7-dimethyl-2-morpholin-4-yl-1-bicyclo[2.2.1]heptanyl)methanesulfonamide

(7,7-dimethyl-2-morpholin-4-yl-1-bicyclo[2.2.1]heptanyl)methanesulfonamide (PubChem CID 141440576) has the molecular formula C14H26N2O3S and a molecular weight of 302.44 g/mol. Its IUPAC name is (7,7-dimethyl-2-morpholin-4-yl-1-bicyclo[2.2.1]heptanyl)methanesulfonamide.

Molecular Properties

Compound Name(7,7-dimethyl-2-morpholin-4-yl-1-bicyclo[2.2.1]heptanyl)methanesulfonamide
PubChem CID141440576
Molecular FormulaC14H26N2O3S
Molecular Weight302.44 g/mol
Exact Mass302.17
IUPAC Name(7,7-dimethyl-2-morpholin-4-yl-1-bicyclo[2.2.1]heptanyl)methanesulfonamide
SMILESCC1(C)C2CCC1(CS(N)(=O)=O)C(N1CCOCC1)C2
InChIInChI=1S/C14H26N2O3S/c1-13(2)11-3-4-14(13,10-20(15,17)18)12(9-11)16-5-7-19-8-6-16/h11-12H,3-10H2,1-2H3,(H2,15,17,18)
InChIKeyVMYORVHQDJEBSA-UHFFFAOYSA-N
XLogP0.80
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.44
LogP ≤ 50.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (7,7-dimethyl-2-morpholin-4-yl-1-bicyclo[2.2.1]heptanyl)methanesulfonamide?
The IUPAC name of (7,7-dimethyl-2-morpholin-4-yl-1-bicyclo[2.2.1]heptanyl)methanesulfonamide (CID 141440576) is (7,7-dimethyl-2-morpholin-4-yl-1-bicyclo[2.2.1]heptanyl)methanesulfonamide.
What is the SMILES notation for (7,7-dimethyl-2-morpholin-4-yl-1-bicyclo[2.2.1]heptanyl)methanesulfonamide?
The canonical SMILES for (7,7-dimethyl-2-morpholin-4-yl-1-bicyclo[2.2.1]heptanyl)methanesulfonamide is CC1(C)C2CCC1(CS(N)(=O)=O)C(N1CCOCC1)C2.
What is the InChIKey of (7,7-dimethyl-2-morpholin-4-yl-1-bicyclo[2.2.1]heptanyl)methanesulfonamide?
The InChIKey is VMYORVHQDJEBSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O3S/c1-13(2)11-3-4-14(13,10-20(15,17)18)12(9-11)16-5-7-19-8-6-16/h11-12H,3-10H2,1-2H3,(H2,15,17,18).
What are the key properties of (7,7-dimethyl-2-morpholin-4-yl-1-bicyclo[2.2.1]heptanyl)methanesulfonamide?
(7,7-dimethyl-2-morpholin-4-yl-1-bicyclo[2.2.1]heptanyl)methanesulfonamide has a molecular weight of 302.44 g/mol, XLogP of 0.80, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (7,7-dimethyl-2-morpholin-4-yl-1-bicyclo[2.2.1]heptanyl)methanesulfonamide is sourced from PubChem (CID 141440576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).