(6R)-7-benzyl-6-methyl-4,7-diazaspiro[2.5]octane-5,8-dione

C14H16N2O2 — CID 58542438

IUPAC(6R)-7-benzyl-6-methyl-4,7-diazaspiro[2.5]octane-5,8-dione
SMILESC[C@@H]1C(=O)NC2(CC2)C(=O)N1Cc1ccccc1
InChIInChI=1S/C14H16N2O2/c1-10-12(17)15-14(7-8-14)13(18)16(10)9-11-5-3-2-4-6-11/h2-6,10H,7-9H2,1H3,(H,15,17)/t10-/m1/s1
InChIKeyDHWUSQGQUPLQLZ-SNVBAGLBSA-N
MW244.29 g/mol
LogP1.07
Rot. Bonds2

About (6R)-7-benzyl-6-methyl-4,7-diazaspiro[2.5]octane-5,8-dione

(6R)-7-benzyl-6-methyl-4,7-diazaspiro[2.5]octane-5,8-dione (PubChem CID 58542438) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is (6R)-7-benzyl-6-methyl-4,7-diazaspiro[2.5]octane-5,8-dione.

Molecular Properties

Compound Name(6R)-7-benzyl-6-methyl-4,7-diazaspiro[2.5]octane-5,8-dione
PubChem CID58542438
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC Name(6R)-7-benzyl-6-methyl-4,7-diazaspiro[2.5]octane-5,8-dione
SMILESC[C@@H]1C(=O)NC2(CC2)C(=O)N1Cc1ccccc1
InChIInChI=1S/C14H16N2O2/c1-10-12(17)15-14(7-8-14)13(18)16(10)9-11-5-3-2-4-6-11/h2-6,10H,7-9H2,1H3,(H,15,17)/t10-/m1/s1
InChIKeyDHWUSQGQUPLQLZ-SNVBAGLBSA-N
XLogP1.07
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (6R)-7-benzyl-6-methyl-4,7-diazaspiro[2.5]octane-5,8-dione?
The IUPAC name of (6R)-7-benzyl-6-methyl-4,7-diazaspiro[2.5]octane-5,8-dione (CID 58542438) is (6R)-7-benzyl-6-methyl-4,7-diazaspiro[2.5]octane-5,8-dione.
What is the SMILES notation for (6R)-7-benzyl-6-methyl-4,7-diazaspiro[2.5]octane-5,8-dione?
The canonical SMILES for (6R)-7-benzyl-6-methyl-4,7-diazaspiro[2.5]octane-5,8-dione is C[C@@H]1C(=O)NC2(CC2)C(=O)N1Cc1ccccc1.
What is the InChIKey of (6R)-7-benzyl-6-methyl-4,7-diazaspiro[2.5]octane-5,8-dione?
The InChIKey is DHWUSQGQUPLQLZ-SNVBAGLBSA-N. The full InChI is InChI=1S/C14H16N2O2/c1-10-12(17)15-14(7-8-14)13(18)16(10)9-11-5-3-2-4-6-11/h2-6,10H,7-9H2,1H3,(H,15,17)/t10-/m1/s1.
What are the key properties of (6R)-7-benzyl-6-methyl-4,7-diazaspiro[2.5]octane-5,8-dione?
(6R)-7-benzyl-6-methyl-4,7-diazaspiro[2.5]octane-5,8-dione has a molecular weight of 244.29 g/mol, XLogP of 1.07, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6R)-7-benzyl-6-methyl-4,7-diazaspiro[2.5]octane-5,8-dione is sourced from PubChem (CID 58542438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).