N-ethyl-N-methyl-2-[2-[(5-methylpyrazin-2-yl)methyl]-3-oxo-2,9-diazaspiro[5.5]undecan-9-yl]acetamide

C20H31N5O2 — CID 70766942

About N-ethyl-N-methyl-2-[2-[(5-methylpyrazin-2-yl)methyl]-3-oxo-2,9-diazaspiro[5.5]undecan-9-yl]acetamide

N-ethyl-N-methyl-2-[2-[(5-methylpyrazin-2-yl)methyl]-3-oxo-2,9-diazaspiro[5.5]undecan-9-yl]acetamide (PubChem CID 70766942) has the molecular formula C20H31N5O2 and a molecular weight of 373.50 g/mol. Its IUPAC name is N-ethyl-N-methyl-2-[2-[(5-methylpyrazin-2-yl)methyl]-3-oxo-2,9-diazaspiro[5.5]undecan-9-yl]acetamide.

Molecular Properties

• Compound Name: N-ethyl-N-methyl-2-[2-[(5-methylpyrazin-2-yl)methyl]-3-oxo-2,9-diazaspiro[5.5]undecan-9-yl]acetamide
• PubChem CID: 70766942
• Molecular Formula: C20H31N5O2
• Molecular Weight: 373.50 g/mol
• Exact Mass: 373.25
• IUPAC Name: N-ethyl-N-methyl-2-[2-[(5-methylpyrazin-2-yl)methyl]-3-oxo-2,9-diazaspiro[5.5]undecan-9-yl]acetamide
• SMILES: CCN(C)C(=O)CN1CCC2(CCC(=O)N(Cc3cnc(C)cn3)C2)CC1
• InChI: InChI=1S/C20H31N5O2/c1-4-23(3)19(27)14-24-9-7-20(8-10-24)6-5-18(26)25(15-20)13-17-12-21-16(2)11-22-17/h11-12H,4-10,13-15H2,1-3H3
• InChIKey: DLGZFMLKUPAUEI-UHFFFAOYSA-N
• XLogP: 1.47
• TPSA: 69.64 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 5
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	373.50
LogP ≤ 5	1.47
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-methyl-2-[2-[(5-methylpyrazin-2-yl)methyl]-3-oxo-2,9-diazaspiro[5.5]undecan-9-yl]acetamide?

The IUPAC name of N-ethyl-N-methyl-2-[2-[(5-methylpyrazin-2-yl)methyl]-3-oxo-2,9-diazaspiro[5.5]undecan-9-yl]acetamide (CID 70766942) is N-ethyl-N-methyl-2-[2-[(5-methylpyrazin-2-yl)methyl]-3-oxo-2,9-diazaspiro[5.5]undecan-9-yl]acetamide.

What is the SMILES notation for N-ethyl-N-methyl-2-[2-[(5-methylpyrazin-2-yl)methyl]-3-oxo-2,9-diazaspiro[5.5]undecan-9-yl]acetamide?

The canonical SMILES for N-ethyl-N-methyl-2-[2-[(5-methylpyrazin-2-yl)methyl]-3-oxo-2,9-diazaspiro[5.5]undecan-9-yl]acetamide is CCN(C)C(=O)CN1CCC2(CCC(=O)N(Cc3cnc(C)cn3)C2)CC1.

What is the InChIKey of N-ethyl-N-methyl-2-[2-[(5-methylpyrazin-2-yl)methyl]-3-oxo-2,9-diazaspiro[5.5]undecan-9-yl]acetamide?

The InChIKey is DLGZFMLKUPAUEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H31N5O2/c1-4-23(3)19(27)14-24-9-7-20(8-10-24)6-5-18(26)25(15-20)13-17-12-21-16(2)11-22-17/h11-12H,4-10,13-15H2,1-3H3.

What are the key properties of N-ethyl-N-methyl-2-[2-[(5-methylpyrazin-2-yl)methyl]-3-oxo-2,9-diazaspiro[5.5]undecan-9-yl]acetamide?

N-ethyl-N-methyl-2-[2-[(5-methylpyrazin-2-yl)methyl]-3-oxo-2,9-diazaspiro[5.5]undecan-9-yl]acetamide has a molecular weight of 373.50 g/mol, XLogP of 1.47, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for N-ethyl-N-methyl-2-[2-[(5-methylpyrazin-2-yl)methyl]-3-oxo-2,9-diazaspiro[5.5]undecan-9-yl]acetamide is sourced from PubChem (CID 70766942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).