1-cyclohexyl-N-(1-propylpiperidin-4-yl)methanesulfonamide

C15H30N2O2S — CID 75419187

IUPAC1-cyclohexyl-N-(1-propylpiperidin-4-yl)methanesulfonamide
SMILESCCCN1CCC(NS(=O)(=O)CC2CCCCC2)CC1
InChIInChI=1S/C15H30N2O2S/c1-2-10-17-11-8-15(9-12-17)16-20(18,19)13-14-6-4-3-5-7-14/h14-16H,2-13H2,1H3
InChIKeyALNJZBMXFCNWKT-UHFFFAOYSA-N
MW302.48 g/mol
LogP2.36
Rot. Bonds6

About 1-cyclohexyl-N-(1-propylpiperidin-4-yl)methanesulfonamide

1-cyclohexyl-N-(1-propylpiperidin-4-yl)methanesulfonamide (PubChem CID 75419187) has the molecular formula C15H30N2O2S and a molecular weight of 302.48 g/mol. Its IUPAC name is 1-cyclohexyl-N-(1-propylpiperidin-4-yl)methanesulfonamide.

Molecular Properties

Compound Name1-cyclohexyl-N-(1-propylpiperidin-4-yl)methanesulfonamide
PubChem CID75419187
Molecular FormulaC15H30N2O2S
Molecular Weight302.48 g/mol
Exact Mass302.20
IUPAC Name1-cyclohexyl-N-(1-propylpiperidin-4-yl)methanesulfonamide
SMILESCCCN1CCC(NS(=O)(=O)CC2CCCCC2)CC1
InChIInChI=1S/C15H30N2O2S/c1-2-10-17-11-8-15(9-12-17)16-20(18,19)13-14-6-4-3-5-7-14/h14-16H,2-13H2,1H3
InChIKeyALNJZBMXFCNWKT-UHFFFAOYSA-N
XLogP2.36
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.48
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 45558322
CID 45558322
CID 45558505
CID 45558505
CID 777548
CID 777548
CID 45558506
CID 45558506
CID 56790967
CID 56790967
CID 64479327
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CID 93870995
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CID 95331031
CID 95331031

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-N-(1-propylpiperidin-4-yl)methanesulfonamide?
The IUPAC name of 1-cyclohexyl-N-(1-propylpiperidin-4-yl)methanesulfonamide (CID 75419187) is 1-cyclohexyl-N-(1-propylpiperidin-4-yl)methanesulfonamide.
What is the SMILES notation for 1-cyclohexyl-N-(1-propylpiperidin-4-yl)methanesulfonamide?
The canonical SMILES for 1-cyclohexyl-N-(1-propylpiperidin-4-yl)methanesulfonamide is CCCN1CCC(NS(=O)(=O)CC2CCCCC2)CC1.
What is the InChIKey of 1-cyclohexyl-N-(1-propylpiperidin-4-yl)methanesulfonamide?
The InChIKey is ALNJZBMXFCNWKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2S/c1-2-10-17-11-8-15(9-12-17)16-20(18,19)13-14-6-4-3-5-7-14/h14-16H,2-13H2,1H3.
What are the key properties of 1-cyclohexyl-N-(1-propylpiperidin-4-yl)methanesulfonamide?
1-cyclohexyl-N-(1-propylpiperidin-4-yl)methanesulfonamide has a molecular weight of 302.48 g/mol, XLogP of 2.36, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-N-(1-propylpiperidin-4-yl)methanesulfonamide is sourced from PubChem (CID 75419187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).