2-cyclohexyloxy-N-piperidin-3-yl-N-(thiolan-2-ylmethyl)acetamide

C18H32N2O2S — CID 140622014

IUPAC2-cyclohexyloxy-N-piperidin-3-yl-N-(thiolan-2-ylmethyl)acetamide
SMILESO=C(COC1CCCCC1)N(CC1CCCS1)C1CCCNC1
InChIInChI=1S/C18H32N2O2S/c21-18(14-22-16-7-2-1-3-8-16)20(13-17-9-5-11-23-17)15-6-4-10-19-12-15/h15-17,19H,1-14H2
InChIKeyNLLJOGXAGPZKRE-UHFFFAOYSA-N
MW340.53 g/mol
LogP2.81
Rot. Bonds6

About 2-cyclohexyloxy-N-piperidin-3-yl-N-(thiolan-2-ylmethyl)acetamide

2-cyclohexyloxy-N-piperidin-3-yl-N-(thiolan-2-ylmethyl)acetamide (PubChem CID 140622014) has the molecular formula C18H32N2O2S and a molecular weight of 340.53 g/mol. Its IUPAC name is 2-cyclohexyloxy-N-piperidin-3-yl-N-(thiolan-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-cyclohexyloxy-N-piperidin-3-yl-N-(thiolan-2-ylmethyl)acetamide
PubChem CID140622014
Molecular FormulaC18H32N2O2S
Molecular Weight340.53 g/mol
Exact Mass340.22
IUPAC Name2-cyclohexyloxy-N-piperidin-3-yl-N-(thiolan-2-ylmethyl)acetamide
SMILESO=C(COC1CCCCC1)N(CC1CCCS1)C1CCCNC1
InChIInChI=1S/C18H32N2O2S/c21-18(14-22-16-7-2-1-3-8-16)20(13-17-9-5-11-23-17)15-6-4-10-19-12-15/h15-17,19H,1-14H2
InChIKeyNLLJOGXAGPZKRE-UHFFFAOYSA-N
XLogP2.81
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.53
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyloxy-N-piperidin-3-yl-N-(thiolan-2-ylmethyl)acetamide?
The IUPAC name of 2-cyclohexyloxy-N-piperidin-3-yl-N-(thiolan-2-ylmethyl)acetamide (CID 140622014) is 2-cyclohexyloxy-N-piperidin-3-yl-N-(thiolan-2-ylmethyl)acetamide.
What is the SMILES notation for 2-cyclohexyloxy-N-piperidin-3-yl-N-(thiolan-2-ylmethyl)acetamide?
The canonical SMILES for 2-cyclohexyloxy-N-piperidin-3-yl-N-(thiolan-2-ylmethyl)acetamide is O=C(COC1CCCCC1)N(CC1CCCS1)C1CCCNC1.
What is the InChIKey of 2-cyclohexyloxy-N-piperidin-3-yl-N-(thiolan-2-ylmethyl)acetamide?
The InChIKey is NLLJOGXAGPZKRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H32N2O2S/c21-18(14-22-16-7-2-1-3-8-16)20(13-17-9-5-11-23-17)15-6-4-10-19-12-15/h15-17,19H,1-14H2.
What are the key properties of 2-cyclohexyloxy-N-piperidin-3-yl-N-(thiolan-2-ylmethyl)acetamide?
2-cyclohexyloxy-N-piperidin-3-yl-N-(thiolan-2-ylmethyl)acetamide has a molecular weight of 340.53 g/mol, XLogP of 2.81, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyloxy-N-piperidin-3-yl-N-(thiolan-2-ylmethyl)acetamide is sourced from PubChem (CID 140622014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).