5-(3,5-dimethylpiperidin-1-yl)sulfonyl-N-propylpyrimidin-2-amine

C14H24N4O2S — CID 62143329

IUPAC5-(3,5-dimethylpiperidin-1-yl)sulfonyl-N-propylpyrimidin-2-amine
SMILESCCCNc1ncc(S(=O)(=O)N2CC(C)CC(C)C2)cn1
InChIInChI=1S/C14H24N4O2S/c1-4-5-15-14-16-7-13(8-17-14)21(19,20)18-9-11(2)6-12(3)10-18/h7-8,11-12H,4-6,9-10H2,1-3H3,(H,15,16,17)
InChIKeyULTAFQSWZLJNEB-UHFFFAOYSA-N
MW312.44 g/mol
LogP1.97
Rot. Bonds5

About 5-(3,5-dimethylpiperidin-1-yl)sulfonyl-N-propylpyrimidin-2-amine

5-(3,5-dimethylpiperidin-1-yl)sulfonyl-N-propylpyrimidin-2-amine (PubChem CID 62143329) has the molecular formula C14H24N4O2S and a molecular weight of 312.44 g/mol. Its IUPAC name is 5-(3,5-dimethylpiperidin-1-yl)sulfonyl-N-propylpyrimidin-2-amine.

Molecular Properties

Compound Name5-(3,5-dimethylpiperidin-1-yl)sulfonyl-N-propylpyrimidin-2-amine
PubChem CID62143329
Molecular FormulaC14H24N4O2S
Molecular Weight312.44 g/mol
Exact Mass312.16
IUPAC Name5-(3,5-dimethylpiperidin-1-yl)sulfonyl-N-propylpyrimidin-2-amine
SMILESCCCNc1ncc(S(=O)(=O)N2CC(C)CC(C)C2)cn1
InChIInChI=1S/C14H24N4O2S/c1-4-5-15-14-16-7-13(8-17-14)21(19,20)18-9-11(2)6-12(3)10-18/h7-8,11-12H,4-6,9-10H2,1-3H3,(H,15,16,17)
InChIKeyULTAFQSWZLJNEB-UHFFFAOYSA-N
XLogP1.97
TPSA75.19 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.44
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-(3,5-dimethylpiperidin-1-yl)sulfonyl-N-propylpyrimidin-2-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

5-(4-ethylpiperidin-1-yl)sulfonyl-N-propylpyrimidin-2-amine
CID 62153138
1-[2-(propylamino)pyrimidin-5-yl]sulfonylpiperidin-4-ol
CID 62142988
1-[1-[2-(propylamino)pyrimidin-5-yl]sulfonylpyrrolidin-3-yl]ethanol
CID 115966968
5-(2,3-dimethylpiperidin-1-yl)sulfonyl-N-propylpyrimidin-2-amine
CID 62147056
5-(2-ethylpyrrolidin-1-yl)sulfonyl-N-propylpyrimidin-2-amine
CID 62164701
[5-(3,4-dimethylpyrrolidin-1-yl)sulfonylpyrimidin-2-yl]hydrazine
CID 79181055
1-[2-(ethylamino)pyrimidin-5-yl]sulfonyl-4-methylpiperidin-3-ol
CID 102964418
(3S,5S)-3,5-dimethyl-1-(4-propoxyphenyl)sulfonylpiperidine
CID 2294126
5-bromo-4-(3,5-dimethylpiperidin-1-yl)-N-propylpyrimidin-2-amine
CID 80767611
3-chloro-5-(3,5-dimethylpiperidin-1-yl)sulfonyl-N-methylpyridin-2-amine
CID 64608504
1-butyl-3-[[5-[(3S,5R)-3,5-dimethylpiperidin-1-yl]sulfonyl-2-pyridinyl]amino]thiourea
CID 51518167
4-(3,5-dimethylpiperidin-1-yl)sulfonylbenzenesulfonyl chloride
CID 50987777

Frequently Asked Questions

What is the IUPAC name of 5-(3,5-dimethylpiperidin-1-yl)sulfonyl-N-propylpyrimidin-2-amine?
The IUPAC name of 5-(3,5-dimethylpiperidin-1-yl)sulfonyl-N-propylpyrimidin-2-amine (CID 62143329) is 5-(3,5-dimethylpiperidin-1-yl)sulfonyl-N-propylpyrimidin-2-amine.
What is the SMILES notation for 5-(3,5-dimethylpiperidin-1-yl)sulfonyl-N-propylpyrimidin-2-amine?
The canonical SMILES for 5-(3,5-dimethylpiperidin-1-yl)sulfonyl-N-propylpyrimidin-2-amine is CCCNc1ncc(S(=O)(=O)N2CC(C)CC(C)C2)cn1.
What is the InChIKey of 5-(3,5-dimethylpiperidin-1-yl)sulfonyl-N-propylpyrimidin-2-amine?
The InChIKey is ULTAFQSWZLJNEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O2S/c1-4-5-15-14-16-7-13(8-17-14)21(19,20)18-9-11(2)6-12(3)10-18/h7-8,11-12H,4-6,9-10H2,1-3H3,(H,15,16,17).
What are the key properties of 5-(3,5-dimethylpiperidin-1-yl)sulfonyl-N-propylpyrimidin-2-amine?
5-(3,5-dimethylpiperidin-1-yl)sulfonyl-N-propylpyrimidin-2-amine has a molecular weight of 312.44 g/mol, XLogP of 1.97, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3,5-dimethylpiperidin-1-yl)sulfonyl-N-propylpyrimidin-2-amine is sourced from PubChem (CID 62143329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).