4-(1-methylcyclopropyl)-1-methylsulfonylpiperidine

C10H19NO2S — CID 58054117

IUPAC4-(1-methylcyclopropyl)-1-methylsulfonylpiperidine
SMILESCC1(C2CCN(S(C)(=O)=O)CC2)CC1
InChIInChI=1S/C10H19NO2S/c1-10(5-6-10)9-3-7-11(8-4-9)14(2,12)13/h9H,3-8H2,1-2H3
InChIKeyKNXNLPBVVGFLPT-UHFFFAOYSA-N
MW217.33 g/mol
LogP1.46
Rot. Bonds2

About 4-(1-methylcyclopropyl)-1-methylsulfonylpiperidine

4-(1-methylcyclopropyl)-1-methylsulfonylpiperidine (PubChem CID 58054117) has the molecular formula C10H19NO2S and a molecular weight of 217.33 g/mol. Its IUPAC name is 4-(1-methylcyclopropyl)-1-methylsulfonylpiperidine.

Molecular Properties

Compound Name4-(1-methylcyclopropyl)-1-methylsulfonylpiperidine
PubChem CID58054117
Molecular FormulaC10H19NO2S
Molecular Weight217.33 g/mol
Exact Mass217.11
IUPAC Name4-(1-methylcyclopropyl)-1-methylsulfonylpiperidine
SMILESCC1(C2CCN(S(C)(=O)=O)CC2)CC1
InChIInChI=1S/C10H19NO2S/c1-10(5-6-10)9-3-7-11(8-4-9)14(2,12)13/h9H,3-8H2,1-2H3
InChIKeyKNXNLPBVVGFLPT-UHFFFAOYSA-N
XLogP1.46
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.33
LogP ≤ 51.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 4-(1-methylcyclopropyl)-1-methylsulfonylpiperidine 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-methylsulfonylpiperidine-4-thiol
CID 130490648
4-bromo-3,3-dimethyl-1-methylsulfonylpiperidine
CID 130533745
1-methylsulfonyl-N-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)piperidin-4-amine
CID 63023322
3,3-dimethyl-1-methylsulfonylpiperidin-4-amine
CID 115269791
4-deuterio-1-methylsulfonylpiperidin-4-amine;hydrochloride
CID 162383208
1-(1-methylsulfonylpiperidin-4-yl)ethanamine
CID 63596040
(4-methyl-1-methylsulfonylpiperidin-4-yl)methanol
CID 58959839
1-methylsulfonylpyrrolidin-3-ol
CID 20745843
7-methylsulfonyl-7-azaspiro[3.5]nonane
CID 126998846
(3R)-1-methylsulfonylpyrrolidin-3-ol
CID 78998740
2,2-dimethyl-5-(4-methylsulfonylpiperazin-1-yl)cyclopentan-1-ol
CID 79857269
4-methylsulfanyloxy-1-methylsulfonylpiperidine
CID 123304187

Frequently Asked Questions

What is the IUPAC name of 4-(1-methylcyclopropyl)-1-methylsulfonylpiperidine?
The IUPAC name of 4-(1-methylcyclopropyl)-1-methylsulfonylpiperidine (CID 58054117) is 4-(1-methylcyclopropyl)-1-methylsulfonylpiperidine.
What is the SMILES notation for 4-(1-methylcyclopropyl)-1-methylsulfonylpiperidine?
The canonical SMILES for 4-(1-methylcyclopropyl)-1-methylsulfonylpiperidine is CC1(C2CCN(S(C)(=O)=O)CC2)CC1.
What is the InChIKey of 4-(1-methylcyclopropyl)-1-methylsulfonylpiperidine?
The InChIKey is KNXNLPBVVGFLPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2S/c1-10(5-6-10)9-3-7-11(8-4-9)14(2,12)13/h9H,3-8H2,1-2H3.
What are the key properties of 4-(1-methylcyclopropyl)-1-methylsulfonylpiperidine?
4-(1-methylcyclopropyl)-1-methylsulfonylpiperidine has a molecular weight of 217.33 g/mol, XLogP of 1.46, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-methylcyclopropyl)-1-methylsulfonylpiperidine is sourced from PubChem (CID 58054117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).