2-cyclopentyloxy-1-[(3R)-3-(methoxymethyl)-2-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl]ethanone

C20H36N2O3 — CID 97476740

About 2-cyclopentyloxy-1-[(3R)-3-(methoxymethyl)-2-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl]ethanone

2-cyclopentyloxy-1-[(3R)-3-(methoxymethyl)-2-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl]ethanone (PubChem CID 97476740) has the molecular formula C20H36N2O3 and a molecular weight of 352.52 g/mol. Its IUPAC name is 2-cyclopentyloxy-1-[(3R)-3-(methoxymethyl)-2-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl]ethanone.

Molecular Properties

• Compound Name: 2-cyclopentyloxy-1-[(3R)-3-(methoxymethyl)-2-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl]ethanone
• PubChem CID: 97476740
• Molecular Formula: C20H36N2O3
• Molecular Weight: 352.52 g/mol
• Exact Mass: 352.27
• IUPAC Name: 2-cyclopentyloxy-1-[(3R)-3-(methoxymethyl)-2-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl]ethanone
• SMILES: COC[C@H]1CC2(CCN(C(=O)COC3CCCC3)CC2)CN1C(C)C
• InChI: InChI=1S/C20H36N2O3/c1-16(2)22-15-20(12-17(22)13-24-3)8-10-21(11-9-20)19(23)14-25-18-6-4-5-7-18/h16-18H,4-15H2,1-3H3/t17-/m1/s1
• InChIKey: RPCQOXXLXSYFPL-QGZVFWFLSA-N
• XLogP: 2.68
• TPSA: 42.01 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 6
• Heavy Atoms: 25
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	352.52
LogP ≤ 5	2.68
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyloxy-1-[(3R)-3-(methoxymethyl)-2-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl]ethanone?

The IUPAC name of 2-cyclopentyloxy-1-[(3R)-3-(methoxymethyl)-2-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl]ethanone (CID 97476740) is 2-cyclopentyloxy-1-[(3R)-3-(methoxymethyl)-2-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl]ethanone.

What is the SMILES notation for 2-cyclopentyloxy-1-[(3R)-3-(methoxymethyl)-2-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl]ethanone?

The canonical SMILES for 2-cyclopentyloxy-1-[(3R)-3-(methoxymethyl)-2-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl]ethanone is COC[C@H]1CC2(CCN(C(=O)COC3CCCC3)CC2)CN1C(C)C.

What is the InChIKey of 2-cyclopentyloxy-1-[(3R)-3-(methoxymethyl)-2-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl]ethanone?

The InChIKey is RPCQOXXLXSYFPL-QGZVFWFLSA-N. The full InChI is InChI=1S/C20H36N2O3/c1-16(2)22-15-20(12-17(22)13-24-3)8-10-21(11-9-20)19(23)14-25-18-6-4-5-7-18/h16-18H,4-15H2,1-3H3/t17-/m1/s1.

What are the key properties of 2-cyclopentyloxy-1-[(3R)-3-(methoxymethyl)-2-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl]ethanone?

2-cyclopentyloxy-1-[(3R)-3-(methoxymethyl)-2-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl]ethanone has a molecular weight of 352.52 g/mol, XLogP of 2.68, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 2-cyclopentyloxy-1-[(3R)-3-(methoxymethyl)-2-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl]ethanone is sourced from PubChem (CID 97476740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).