1-(3-amino-2,2-dimethylpropanoyl)-3-[(sulfamoylamino)methyl]piperidine

C11H24N4O3S — CID 115426454

IUPAC1-(3-amino-2,2-dimethylpropanoyl)-3-[(sulfamoylamino)methyl]piperidine
SMILESCC(C)(CN)C(=O)N1CCCC(CNS(N)(=O)=O)C1
InChIInChI=1S/C11H24N4O3S/c1-11(2,8-12)10(16)15-5-3-4-9(7-15)6-14-19(13,17)18/h9,14H,3-8,12H2,1-2H3,(H2,13,17,18)
InChIKeyPIAKPRBEKLFWNO-UHFFFAOYSA-N
MW292.41 g/mol
LogP-1.00
Rot. Bonds5

About 1-(3-amino-2,2-dimethylpropanoyl)-3-[(sulfamoylamino)methyl]piperidine

1-(3-amino-2,2-dimethylpropanoyl)-3-[(sulfamoylamino)methyl]piperidine (PubChem CID 115426454) has the molecular formula C11H24N4O3S and a molecular weight of 292.41 g/mol. Its IUPAC name is 1-(3-amino-2,2-dimethylpropanoyl)-3-[(sulfamoylamino)methyl]piperidine.

Molecular Properties

Compound Name1-(3-amino-2,2-dimethylpropanoyl)-3-[(sulfamoylamino)methyl]piperidine
PubChem CID115426454
Molecular FormulaC11H24N4O3S
Molecular Weight292.41 g/mol
Exact Mass292.16
IUPAC Name1-(3-amino-2,2-dimethylpropanoyl)-3-[(sulfamoylamino)methyl]piperidine
SMILESCC(C)(CN)C(=O)N1CCCC(CNS(N)(=O)=O)C1
InChIInChI=1S/C11H24N4O3S/c1-11(2,8-12)10(16)15-5-3-4-9(7-15)6-14-19(13,17)18/h9,14H,3-8,12H2,1-2H3,(H2,13,17,18)
InChIKeyPIAKPRBEKLFWNO-UHFFFAOYSA-N
XLogP-1.00
TPSA118.52 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.41
LogP ≤ 5-1.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[1-(3-amino-2,2-dimethylpropanoyl)piperidin-3-yl]methyl]methanesulfonamide;hydrochloride
CID 119722478
1-[2-methyl-2-(methylamino)propanoyl]-3-[(sulfamoylamino)methyl]piperidine
CID 62846901
1-(2-aminopropanoyl)-3-[(sulfamoylamino)methyl]piperidine
CID 54873272
3-amino-1-(3-aminopiperidin-1-yl)-2,2-dimethylpropan-1-one;hydrochloride
CID 130637170
1-(4-amino-3-methylbutanoyl)-3-[(sulfamoylamino)methyl]piperidine
CID 81086812
1-(2-cyclobutylacetyl)-3-[(sulfamoylamino)methyl]piperidine
CID 113244692
1-but-2-ynoyl-3-[(sulfamoylamino)methyl]piperidine
CID 107992574
1-(3-chloro-2-methylpropanoyl)-3-[(sulfamoylamino)methyl]piperidine
CID 62727034
1-(2-propan-2-yloxyacetyl)-3-[(sulfamoylamino)methyl]piperidine
CID 112692537
2-amino-N-[2-oxo-2-[3-[(sulfamoylamino)methyl]piperidin-1-yl]ethyl]acetamide
CID 60963858
1-heptanoyl-3-[(sulfamoylamino)methyl]piperidine
CID 115642411
1-[4-(methylamino)butanoyl]-3-[(sulfamoylamino)methyl]piperidine
CID 54873297

Frequently Asked Questions

What is the IUPAC name of 1-(3-amino-2,2-dimethylpropanoyl)-3-[(sulfamoylamino)methyl]piperidine?
The IUPAC name of 1-(3-amino-2,2-dimethylpropanoyl)-3-[(sulfamoylamino)methyl]piperidine (CID 115426454) is 1-(3-amino-2,2-dimethylpropanoyl)-3-[(sulfamoylamino)methyl]piperidine.
What is the SMILES notation for 1-(3-amino-2,2-dimethylpropanoyl)-3-[(sulfamoylamino)methyl]piperidine?
The canonical SMILES for 1-(3-amino-2,2-dimethylpropanoyl)-3-[(sulfamoylamino)methyl]piperidine is CC(C)(CN)C(=O)N1CCCC(CNS(N)(=O)=O)C1.
What is the InChIKey of 1-(3-amino-2,2-dimethylpropanoyl)-3-[(sulfamoylamino)methyl]piperidine?
The InChIKey is PIAKPRBEKLFWNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N4O3S/c1-11(2,8-12)10(16)15-5-3-4-9(7-15)6-14-19(13,17)18/h9,14H,3-8,12H2,1-2H3,(H2,13,17,18).
What are the key properties of 1-(3-amino-2,2-dimethylpropanoyl)-3-[(sulfamoylamino)methyl]piperidine?
1-(3-amino-2,2-dimethylpropanoyl)-3-[(sulfamoylamino)methyl]piperidine has a molecular weight of 292.41 g/mol, XLogP of -1.00, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-amino-2,2-dimethylpropanoyl)-3-[(sulfamoylamino)methyl]piperidine is sourced from PubChem (CID 115426454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).