2-[2-(dimethylamino)-6-oxo-2-phenyl-5,7-diazaspiro[3.4]octan-7-yl]acetamide

C16H22N4O2 — CID 137407639

IUPAC2-[2-(dimethylamino)-6-oxo-2-phenyl-5,7-diazaspiro[3.4]octan-7-yl]acetamide
SMILESCN(C)C1(c2ccccc2)CC2(CN(CC(N)=O)C(=O)N2)C1
InChIInChI=1S/C16H22N4O2/c1-19(2)16(12-6-4-3-5-7-12)9-15(10-16)11-20(8-13(17)21)14(22)18-15/h3-7H,8-11H2,1-2H3,(H2,17,21)(H,18,22)
InChIKeyOZQFRQJHEDXCOR-UHFFFAOYSA-N
MW302.38 g/mol
LogP0.49
Rot. Bonds4

About 2-[2-(dimethylamino)-6-oxo-2-phenyl-5,7-diazaspiro[3.4]octan-7-yl]acetamide

2-[2-(dimethylamino)-6-oxo-2-phenyl-5,7-diazaspiro[3.4]octan-7-yl]acetamide (PubChem CID 137407639) has the molecular formula C16H22N4O2 and a molecular weight of 302.38 g/mol. Its IUPAC name is 2-[2-(dimethylamino)-6-oxo-2-phenyl-5,7-diazaspiro[3.4]octan-7-yl]acetamide.

Molecular Properties

Compound Name2-[2-(dimethylamino)-6-oxo-2-phenyl-5,7-diazaspiro[3.4]octan-7-yl]acetamide
PubChem CID137407639
Molecular FormulaC16H22N4O2
Molecular Weight302.38 g/mol
Exact Mass302.17
IUPAC Name2-[2-(dimethylamino)-6-oxo-2-phenyl-5,7-diazaspiro[3.4]octan-7-yl]acetamide
SMILESCN(C)C1(c2ccccc2)CC2(CN(CC(N)=O)C(=O)N2)C1
InChIInChI=1S/C16H22N4O2/c1-19(2)16(12-6-4-3-5-7-12)9-15(10-16)11-20(8-13(17)21)14(22)18-15/h3-7H,8-11H2,1-2H3,(H2,17,21)(H,18,22)
InChIKeyOZQFRQJHEDXCOR-UHFFFAOYSA-N
XLogP0.49
TPSA78.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.38
LogP ≤ 50.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

8-(dimethylamino)-3-ethyl-8-phenyl-1,3-diazaspiro[4.5]decan-2-one
CID 130246925
2-[[8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]methyl]-3,3-dimethylbutanoic acid
CID 130200978
2-[8-(dimethylamino)-2-oxo-8-phenyl-1-(2,2,2-trifluoroethyl)-1,3-diazaspiro[4.5]decan-3-yl]acetamide
CID 130209737
2-(dimethylamino)-7-[4-(2-hydroxypropan-2-yl)-2-methylphenyl]-2-phenyl-5,7-diazaspiro[3.4]octan-6-one
CID 137407638
2-[8-[(2-amino-2-oxoethyl)-methylamino]-1-methyl-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]acetamide
CID 140797752
2-(dimethylamino)-2-(3-fluorophenyl)-7-[(4-methoxyphenyl)methyl]-5,7-diazaspiro[3.4]octan-6-one
CID 137407670
N-(2-amino-2-oxoethyl)-N-methyl-2-[(5S,8R)-8-(methylamino)-2-oxo-7-phenyl-1,3-diazaspiro[4.5]decan-3-yl]acetamide
CID 130219425
2-[8-(dimethylamino)-2-oxo-8-[3-(2,2,2-trifluoroacetyl)oxyphenyl]-1,3-diazaspiro[4.5]decan-3-yl]acetic acid
CID 130219638
8-(dimethylamino)-3-[(3-methyl-6-piperazin-1-ylcyclohepta-1,6-dien-4-yn-1-yl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one
CID 130249034
3-(1,3-benzodioxol-4-ylmethyl)-8-(dimethylamino)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one
CID 130202549
methyl 5-[8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carboxylate
CID 130200971
5-[8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyridine-2-carboxylic acid
CID 156757627

Frequently Asked Questions

What is the IUPAC name of 2-[2-(dimethylamino)-6-oxo-2-phenyl-5,7-diazaspiro[3.4]octan-7-yl]acetamide?
The IUPAC name of 2-[2-(dimethylamino)-6-oxo-2-phenyl-5,7-diazaspiro[3.4]octan-7-yl]acetamide (CID 137407639) is 2-[2-(dimethylamino)-6-oxo-2-phenyl-5,7-diazaspiro[3.4]octan-7-yl]acetamide.
What is the SMILES notation for 2-[2-(dimethylamino)-6-oxo-2-phenyl-5,7-diazaspiro[3.4]octan-7-yl]acetamide?
The canonical SMILES for 2-[2-(dimethylamino)-6-oxo-2-phenyl-5,7-diazaspiro[3.4]octan-7-yl]acetamide is CN(C)C1(c2ccccc2)CC2(CN(CC(N)=O)C(=O)N2)C1.
What is the InChIKey of 2-[2-(dimethylamino)-6-oxo-2-phenyl-5,7-diazaspiro[3.4]octan-7-yl]acetamide?
The InChIKey is OZQFRQJHEDXCOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4O2/c1-19(2)16(12-6-4-3-5-7-12)9-15(10-16)11-20(8-13(17)21)14(22)18-15/h3-7H,8-11H2,1-2H3,(H2,17,21)(H,18,22).
What are the key properties of 2-[2-(dimethylamino)-6-oxo-2-phenyl-5,7-diazaspiro[3.4]octan-7-yl]acetamide?
2-[2-(dimethylamino)-6-oxo-2-phenyl-5,7-diazaspiro[3.4]octan-7-yl]acetamide has a molecular weight of 302.38 g/mol, XLogP of 0.49, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(dimethylamino)-6-oxo-2-phenyl-5,7-diazaspiro[3.4]octan-7-yl]acetamide is sourced from PubChem (CID 137407639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).