3-(methylsulfonylmethyl)-3-propan-2-yl-azanidacyclobutane;uranium

C8H16NO2SU- — CID 170937697

IUPAC3-(methylsulfonylmethyl)-3-propan-2-yl-azanidacyclobutane;uranium
SMILESCC(C)C1(CS(C)(=O)=O)C[N-]C1.[U]
InChIInChI=1S/C8H16NO2S.U/c1-7(2)8(4-9-5-8)6-12(3,10)11;/h7H,4-6H2,1-3H3;/q-1;
InChIKeyHFTCKQKLPZHBAW-UHFFFAOYSA-N
MW428.32 g/mol
LogP1.06
Rot. Bonds3

About 3-(methylsulfonylmethyl)-3-propan-2-yl-azanidacyclobutane;uranium

3-(methylsulfonylmethyl)-3-propan-2-yl-azanidacyclobutane;uranium (PubChem CID 170937697) has the molecular formula C8H16NO2SU- and a molecular weight of 428.32 g/mol. Its IUPAC name is 3-(methylsulfonylmethyl)-3-propan-2-yl-azanidacyclobutane;uranium.

Molecular Properties

Compound Name3-(methylsulfonylmethyl)-3-propan-2-yl-azanidacyclobutane;uranium
PubChem CID170937697
Molecular FormulaC8H16NO2SU-
Molecular Weight428.32 g/mol
Exact Mass428.14
IUPAC Name3-(methylsulfonylmethyl)-3-propan-2-yl-azanidacyclobutane;uranium
SMILESCC(C)C1(CS(C)(=O)=O)C[N-]C1.[U]
InChIInChI=1S/C8H16NO2S.U/c1-7(2)8(4-9-5-8)6-12(3,10)11;/h7H,4-6H2,1-3H3;/q-1;
InChIKeyHFTCKQKLPZHBAW-UHFFFAOYSA-N
XLogP1.06
TPSA48.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500428.32
LogP ≤ 51.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-Ethyl-1-(3-methyl-3-methylsulfonylbutyl)sulfonylazetidine
CID 136548119
2,2,3,3-Tetramethyl-1-(2-methylsulfonylethyl)azetidine
CID 71861019
1-(3-Methylbutyl)-3-methylsulfonylazetidine
CID 59761793
3-Methyl-3-(1-methylsulfonylethyl)-1-propan-2-ylazetidine
CID 59882509
1-(2-Methylsulfonylethyl)-3-propan-2-ylazetidine
CID 122414288
3-Tert-butyl-1-methyl-3-methylsulfonylazetidine
CID 126763963
3-Tert-butyl-1-ethylsulfonylazetidine
CID 146624586
3-Ethyl-1-methyl-3-propan-2-ylsulfonylazetidine
CID 164831348
3-Methyl-3-propan-2-yl-1-propan-2-ylsulfonylazetidine
CID 167155871
3-Ethyl-1-methyl-3-(2-methylsulfonylethyl)azetidine
CID 167285444
3-(Tert-butylsulfinylmethyl)-1-methyl-3-propan-2-ylazetidine
CID 167651470
3-(3-Methyl-1-methylsulfonylbutan-2-yl)-azanidacyclobutane;uranium
CID 170937685

Frequently Asked Questions

What is the IUPAC name of 3-(methylsulfonylmethyl)-3-propan-2-yl-azanidacyclobutane;uranium?
The IUPAC name of 3-(methylsulfonylmethyl)-3-propan-2-yl-azanidacyclobutane;uranium (CID 170937697) is 3-(methylsulfonylmethyl)-3-propan-2-yl-azanidacyclobutane;uranium.
What is the SMILES notation for 3-(methylsulfonylmethyl)-3-propan-2-yl-azanidacyclobutane;uranium?
The canonical SMILES for 3-(methylsulfonylmethyl)-3-propan-2-yl-azanidacyclobutane;uranium is CC(C)C1(CS(C)(=O)=O)C[N-]C1.[U].
What is the InChIKey of 3-(methylsulfonylmethyl)-3-propan-2-yl-azanidacyclobutane;uranium?
The InChIKey is HFTCKQKLPZHBAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16NO2S.U/c1-7(2)8(4-9-5-8)6-12(3,10)11;/h7H,4-6H2,1-3H3;/q-1;.
What are the key properties of 3-(methylsulfonylmethyl)-3-propan-2-yl-azanidacyclobutane;uranium?
3-(methylsulfonylmethyl)-3-propan-2-yl-azanidacyclobutane;uranium has a molecular weight of 428.32 g/mol, XLogP of 1.06, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methylsulfonylmethyl)-3-propan-2-yl-azanidacyclobutane;uranium is sourced from PubChem (CID 170937697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).