2-cyclopentyloxy-N-[[4-[(3,5-dimethylpiperidin-1-yl)methyl]phenyl]methyl]acetamide

C22H34N2O2 — CID 60515116

IUPAC2-cyclopentyloxy-N-[[4-[(3,5-dimethylpiperidin-1-yl)methyl]phenyl]methyl]acetamide
SMILESCC1CC(C)CN(Cc2ccc(CNC(=O)COC3CCCC3)cc2)C1
InChIInChI=1S/C22H34N2O2/c1-17-11-18(2)14-24(13-17)15-20-9-7-19(8-10-20)12-23-22(25)16-26-21-5-3-4-6-21/h7-10,17-18,21H,3-6,11-16H2,1-2H3,(H,23,25)
InChIKeyUHXYQXXRHMZCCN-UHFFFAOYSA-N
MW358.53 g/mol
LogP3.74
Rot. Bonds7

About 2-cyclopentyloxy-N-[[4-[(3,5-dimethylpiperidin-1-yl)methyl]phenyl]methyl]acetamide

2-cyclopentyloxy-N-[[4-[(3,5-dimethylpiperidin-1-yl)methyl]phenyl]methyl]acetamide (PubChem CID 60515116) has the molecular formula C22H34N2O2 and a molecular weight of 358.53 g/mol. Its IUPAC name is 2-cyclopentyloxy-N-[[4-[(3,5-dimethylpiperidin-1-yl)methyl]phenyl]methyl]acetamide.

Molecular Properties

Compound Name2-cyclopentyloxy-N-[[4-[(3,5-dimethylpiperidin-1-yl)methyl]phenyl]methyl]acetamide
PubChem CID60515116
Molecular FormulaC22H34N2O2
Molecular Weight358.53 g/mol
Exact Mass358.26
IUPAC Name2-cyclopentyloxy-N-[[4-[(3,5-dimethylpiperidin-1-yl)methyl]phenyl]methyl]acetamide
SMILESCC1CC(C)CN(Cc2ccc(CNC(=O)COC3CCCC3)cc2)C1
InChIInChI=1S/C22H34N2O2/c1-17-11-18(2)14-24(13-17)15-20-9-7-19(8-10-20)12-23-22(25)16-26-21-5-3-4-6-21/h7-10,17-18,21H,3-6,11-16H2,1-2H3,(H,23,25)
InChIKeyUHXYQXXRHMZCCN-UHFFFAOYSA-N
XLogP3.74
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.53
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyloxy-N-[[4-[(3,5-dimethylpiperidin-1-yl)methyl]phenyl]methyl]acetamide?
The IUPAC name of 2-cyclopentyloxy-N-[[4-[(3,5-dimethylpiperidin-1-yl)methyl]phenyl]methyl]acetamide (CID 60515116) is 2-cyclopentyloxy-N-[[4-[(3,5-dimethylpiperidin-1-yl)methyl]phenyl]methyl]acetamide.
What is the SMILES notation for 2-cyclopentyloxy-N-[[4-[(3,5-dimethylpiperidin-1-yl)methyl]phenyl]methyl]acetamide?
The canonical SMILES for 2-cyclopentyloxy-N-[[4-[(3,5-dimethylpiperidin-1-yl)methyl]phenyl]methyl]acetamide is CC1CC(C)CN(Cc2ccc(CNC(=O)COC3CCCC3)cc2)C1.
What is the InChIKey of 2-cyclopentyloxy-N-[[4-[(3,5-dimethylpiperidin-1-yl)methyl]phenyl]methyl]acetamide?
The InChIKey is UHXYQXXRHMZCCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H34N2O2/c1-17-11-18(2)14-24(13-17)15-20-9-7-19(8-10-20)12-23-22(25)16-26-21-5-3-4-6-21/h7-10,17-18,21H,3-6,11-16H2,1-2H3,(H,23,25).
What are the key properties of 2-cyclopentyloxy-N-[[4-[(3,5-dimethylpiperidin-1-yl)methyl]phenyl]methyl]acetamide?
2-cyclopentyloxy-N-[[4-[(3,5-dimethylpiperidin-1-yl)methyl]phenyl]methyl]acetamide has a molecular weight of 358.53 g/mol, XLogP of 3.74, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyloxy-N-[[4-[(3,5-dimethylpiperidin-1-yl)methyl]phenyl]methyl]acetamide is sourced from PubChem (CID 60515116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).