[2-[2-(4-hydroxycyclohexyl)-1-oxo-2,9-diazaspiro[4.5]decan-9-yl]-6-methoxy-3-pyridinyl] N-ethylcarbamate

C23H34N4O5 — CID 90865215

About [2-[2-(4-hydroxycyclohexyl)-1-oxo-2,9-diazaspiro[4.5]decan-9-yl]-6-methoxy-3-pyridinyl] N-ethylcarbamate

[2-[2-(4-hydroxycyclohexyl)-1-oxo-2,9-diazaspiro[4.5]decan-9-yl]-6-methoxy-3-pyridinyl] N-ethylcarbamate (PubChem CID 90865215) has the molecular formula C23H34N4O5 and a molecular weight of 446.55 g/mol. Its IUPAC name is [2-[2-(4-hydroxycyclohexyl)-1-oxo-2,9-diazaspiro[4.5]decan-9-yl]-6-methoxy-3-pyridinyl] N-ethylcarbamate.

Molecular Properties

• Compound Name: [2-[2-(4-hydroxycyclohexyl)-1-oxo-2,9-diazaspiro[4.5]decan-9-yl]-6-methoxy-3-pyridinyl] N-ethylcarbamate
• PubChem CID: 90865215
• Molecular Formula: C23H34N4O5
• Molecular Weight: 446.55 g/mol
• Exact Mass: 446.25
• IUPAC Name: [2-[2-(4-hydroxycyclohexyl)-1-oxo-2,9-diazaspiro[4.5]decan-9-yl]-6-methoxy-3-pyridinyl] N-ethylcarbamate
• SMILES: CCNC(=O)Oc1ccc(OC)nc1N1CCCC2(CCN(C3CCC(O)CC3)C2=O)C1
• InChI: InChI=1S/C23H34N4O5/c1-3-24-22(30)32-18-9-10-19(31-2)25-20(18)26-13-4-11-23(15-26)12-14-27(21(23)29)16-5-7-17(28)8-6-16/h9-10,16-17,28H,3-8,11-15H2,1-2H3,(H,24,30)
• InChIKey: IWMJCVQFOFGOGW-UHFFFAOYSA-N
• XLogP: 2.32
• TPSA: 104.23 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 7
• Rotatable Bonds: 5
• Heavy Atoms: 32
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	446.55
LogP ≤ 5	2.32
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of [2-[2-(4-hydroxycyclohexyl)-1-oxo-2,9-diazaspiro[4.5]decan-9-yl]-6-methoxy-3-pyridinyl] N-ethylcarbamate?

The IUPAC name of [2-[2-(4-hydroxycyclohexyl)-1-oxo-2,9-diazaspiro[4.5]decan-9-yl]-6-methoxy-3-pyridinyl] N-ethylcarbamate (CID 90865215) is [2-[2-(4-hydroxycyclohexyl)-1-oxo-2,9-diazaspiro[4.5]decan-9-yl]-6-methoxy-3-pyridinyl] N-ethylcarbamate.

What is the SMILES notation for [2-[2-(4-hydroxycyclohexyl)-1-oxo-2,9-diazaspiro[4.5]decan-9-yl]-6-methoxy-3-pyridinyl] N-ethylcarbamate?

The canonical SMILES for [2-[2-(4-hydroxycyclohexyl)-1-oxo-2,9-diazaspiro[4.5]decan-9-yl]-6-methoxy-3-pyridinyl] N-ethylcarbamate is CCNC(=O)Oc1ccc(OC)nc1N1CCCC2(CCN(C3CCC(O)CC3)C2=O)C1.

What is the InChIKey of [2-[2-(4-hydroxycyclohexyl)-1-oxo-2,9-diazaspiro[4.5]decan-9-yl]-6-methoxy-3-pyridinyl] N-ethylcarbamate?

The InChIKey is IWMJCVQFOFGOGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H34N4O5/c1-3-24-22(30)32-18-9-10-19(31-2)25-20(18)26-13-4-11-23(15-26)12-14-27(21(23)29)16-5-7-17(28)8-6-16/h9-10,16-17,28H,3-8,11-15H2,1-2H3,(H,24,30).

What are the key properties of [2-[2-(4-hydroxycyclohexyl)-1-oxo-2,9-diazaspiro[4.5]decan-9-yl]-6-methoxy-3-pyridinyl] N-ethylcarbamate?

[2-[2-(4-hydroxycyclohexyl)-1-oxo-2,9-diazaspiro[4.5]decan-9-yl]-6-methoxy-3-pyridinyl] N-ethylcarbamate has a molecular weight of 446.55 g/mol, XLogP of 2.32, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for [2-[2-(4-hydroxycyclohexyl)-1-oxo-2,9-diazaspiro[4.5]decan-9-yl]-6-methoxy-3-pyridinyl] N-ethylcarbamate is sourced from PubChem (CID 90865215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).