3,3-dimethyl-1-[1-(oxolan-3-yl)pyrazol-4-yl]sulfonylpiperidin-4-amine

C14H24N4O3S — CID 120778866

IUPAC3,3-dimethyl-1-[1-(oxolan-3-yl)pyrazol-4-yl]sulfonylpiperidin-4-amine
SMILESCC1(C)CN(S(=O)(=O)c2cnn(C3CCOC3)c2)CCC1N
InChIInChI=1S/C14H24N4O3S/c1-14(2)10-17(5-3-13(14)15)22(19,20)12-7-16-18(8-12)11-4-6-21-9-11/h7-8,11,13H,3-6,9-10,15H2,1-2H3
InChIKeyCRMFWLBCAXBXLI-UHFFFAOYSA-N
MW328.44 g/mol
LogP0.59
Rot. Bonds3

About 3,3-dimethyl-1-[1-(oxolan-3-yl)pyrazol-4-yl]sulfonylpiperidin-4-amine

3,3-dimethyl-1-[1-(oxolan-3-yl)pyrazol-4-yl]sulfonylpiperidin-4-amine (PubChem CID 120778866) has the molecular formula C14H24N4O3S and a molecular weight of 328.44 g/mol. Its IUPAC name is 3,3-dimethyl-1-[1-(oxolan-3-yl)pyrazol-4-yl]sulfonylpiperidin-4-amine.

Molecular Properties

Compound Name3,3-dimethyl-1-[1-(oxolan-3-yl)pyrazol-4-yl]sulfonylpiperidin-4-amine
PubChem CID120778866
Molecular FormulaC14H24N4O3S
Molecular Weight328.44 g/mol
Exact Mass328.16
IUPAC Name3,3-dimethyl-1-[1-(oxolan-3-yl)pyrazol-4-yl]sulfonylpiperidin-4-amine
SMILESCC1(C)CN(S(=O)(=O)c2cnn(C3CCOC3)c2)CCC1N
InChIInChI=1S/C14H24N4O3S/c1-14(2)10-17(5-3-13(14)15)22(19,20)12-7-16-18(8-12)11-4-6-21-9-11/h7-8,11,13H,3-6,9-10,15H2,1-2H3
InChIKeyCRMFWLBCAXBXLI-UHFFFAOYSA-N
XLogP0.59
TPSA90.45 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.44
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 3,3-dimethyl-1-[1-(oxolan-3-yl)pyrazol-4-yl]sulfonylpiperidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(oxolan-3-yl)pyrazole-4-sulfonyl fluoride
CID 154832131
2,2-dimethyl-1-[1-(oxolan-3-yl)pyrazol-4-yl]sulfonyl-3H-indole
CID 167784849
3,3-dimethyl-1-(1-phenylpyrazol-4-yl)sulfonylpiperidin-4-amine;hydrochloride
CID 120779609
2-[1-(oxolan-3-yl)pyrazol-4-yl]sulfonylguanidine
CID 167856354
1-(1,2-dimethylimidazol-4-yl)sulfonyl-3,3-dimethylpiperidin-4-amine
CID 120779338
3,3-dimethyl-1-(oxolan-3-ylmethylsulfonyl)piperidin-4-amine
CID 120779200
2,2-dimethyl-1-[1-(oxan-4-yl)pyrazol-4-yl]sulfonyl-3H-indole
CID 126825116
3,3-dimethyl-1-(1H-pyrrol-3-ylsulfonyl)piperidin-4-amine
CID 114267693
3,3-dimethyl-1-(oxan-3-ylsulfonyl)piperidin-4-amine;hydrochloride
CID 120877009
N-[2-amino-2-(4-methylphenyl)ethyl]-1-(oxolan-3-yl)pyrazole-4-sulfonamide
CID 167788723
5-[1-(oxan-4-yl)pyrazol-4-yl]sulfonyl-6,7-dihydro-4H-thieno[3,2-c]pyridine
CID 99629788
ethane;4-methyl-1-(oxolan-3-yl)pyrazole
CID 143510060

Frequently Asked Questions

What is the IUPAC name of 3,3-dimethyl-1-[1-(oxolan-3-yl)pyrazol-4-yl]sulfonylpiperidin-4-amine?
The IUPAC name of 3,3-dimethyl-1-[1-(oxolan-3-yl)pyrazol-4-yl]sulfonylpiperidin-4-amine (CID 120778866) is 3,3-dimethyl-1-[1-(oxolan-3-yl)pyrazol-4-yl]sulfonylpiperidin-4-amine.
What is the SMILES notation for 3,3-dimethyl-1-[1-(oxolan-3-yl)pyrazol-4-yl]sulfonylpiperidin-4-amine?
The canonical SMILES for 3,3-dimethyl-1-[1-(oxolan-3-yl)pyrazol-4-yl]sulfonylpiperidin-4-amine is CC1(C)CN(S(=O)(=O)c2cnn(C3CCOC3)c2)CCC1N.
What is the InChIKey of 3,3-dimethyl-1-[1-(oxolan-3-yl)pyrazol-4-yl]sulfonylpiperidin-4-amine?
The InChIKey is CRMFWLBCAXBXLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O3S/c1-14(2)10-17(5-3-13(14)15)22(19,20)12-7-16-18(8-12)11-4-6-21-9-11/h7-8,11,13H,3-6,9-10,15H2,1-2H3.
What are the key properties of 3,3-dimethyl-1-[1-(oxolan-3-yl)pyrazol-4-yl]sulfonylpiperidin-4-amine?
3,3-dimethyl-1-[1-(oxolan-3-yl)pyrazol-4-yl]sulfonylpiperidin-4-amine has a molecular weight of 328.44 g/mol, XLogP of 0.59, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-dimethyl-1-[1-(oxolan-3-yl)pyrazol-4-yl]sulfonylpiperidin-4-amine is sourced from PubChem (CID 120778866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).