6-[1-(dimethylamino)-4-methylpentan-2-yl]-5-ethyl-4,6-diazaspiro[2.4]heptan-7-one

C15H29N3O — CID 83247410

IUPAC6-[1-(dimethylamino)-4-methylpentan-2-yl]-5-ethyl-4,6-diazaspiro[2.4]heptan-7-one
SMILESCCC1NC2(CC2)C(=O)N1C(CC(C)C)CN(C)C
InChIInChI=1S/C15H29N3O/c1-6-13-16-15(7-8-15)14(19)18(13)12(9-11(2)3)10-17(4)5/h11-13,16H,6-10H2,1-5H3
InChIKeyHHDZTYPWCRUMBY-UHFFFAOYSA-N
MW267.42 g/mol
LogP1.66
Rot. Bonds6

About 6-[1-(dimethylamino)-4-methylpentan-2-yl]-5-ethyl-4,6-diazaspiro[2.4]heptan-7-one

6-[1-(dimethylamino)-4-methylpentan-2-yl]-5-ethyl-4,6-diazaspiro[2.4]heptan-7-one (PubChem CID 83247410) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is 6-[1-(dimethylamino)-4-methylpentan-2-yl]-5-ethyl-4,6-diazaspiro[2.4]heptan-7-one.

Molecular Properties

Compound Name6-[1-(dimethylamino)-4-methylpentan-2-yl]-5-ethyl-4,6-diazaspiro[2.4]heptan-7-one
PubChem CID83247410
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC Name6-[1-(dimethylamino)-4-methylpentan-2-yl]-5-ethyl-4,6-diazaspiro[2.4]heptan-7-one
SMILESCCC1NC2(CC2)C(=O)N1C(CC(C)C)CN(C)C
InChIInChI=1S/C15H29N3O/c1-6-13-16-15(7-8-15)14(19)18(13)12(9-11(2)3)10-17(4)5/h11-13,16H,6-10H2,1-5H3
InChIKeyHHDZTYPWCRUMBY-UHFFFAOYSA-N
XLogP1.66
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-[1-(dimethylamino)-4-methylpentan-2-yl]-5-ethyl-4,6-diazaspiro[2.4]heptan-7-one with MolForge

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Related Compounds

5-ethyl-6-(6-methylheptan-2-yl)-4,6-diazaspiro[2.4]heptan-7-one
CID 83254085
3-butan-2-yl-2-ethyl-1,3-diazaspiro[4.4]nonan-4-one
CID 83239839
2-ethyl-3-(4-methylhexan-2-yl)-1,3-diazaspiro[4.4]nonan-4-one
CID 83264245
5-ethyl-6-(1-methoxy-3-methylbutan-2-yl)-4,6-diazaspiro[2.4]heptan-7-one
CID 83258737
2-ethyl-3-(3-methylpentan-2-yl)-1,3-diazaspiro[4.4]nonan-4-one
CID 83247368
2-cyclopentyl-3-[1-(dimethylamino)-4-methylpentan-2-yl]imidazolidin-4-one
CID 83247154
3-[1-(dimethylamino)-3-methylbutan-2-yl]-2,5-diethyl-5-methylimidazolidin-4-one
CID 83249274
5-ethyl-6-[2-[ethyl(methyl)amino]ethyl]-4,6-diazaspiro[2.4]heptan-7-one
CID 83255547
6-(2-methylpentan-3-yl)-5-(2-methylpropyl)-4,6-diazaspiro[2.4]heptan-7-one
CID 83247398
6-hexan-2-yl-5-(2-methylpropyl)-4,6-diazaspiro[2.4]heptan-7-one
CID 83252507
3-[1-(dimethylamino)-4-methylpentan-2-yl]-2-methyl-5-(2-methylpropyl)imidazolidin-4-one
CID 83248649
6-(2-methylpropyl)-5-propyl-4,6-diazaspiro[2.4]heptan-7-one
CID 83242401

Frequently Asked Questions

What is the IUPAC name of 6-[1-(dimethylamino)-4-methylpentan-2-yl]-5-ethyl-4,6-diazaspiro[2.4]heptan-7-one?
The IUPAC name of 6-[1-(dimethylamino)-4-methylpentan-2-yl]-5-ethyl-4,6-diazaspiro[2.4]heptan-7-one (CID 83247410) is 6-[1-(dimethylamino)-4-methylpentan-2-yl]-5-ethyl-4,6-diazaspiro[2.4]heptan-7-one.
What is the SMILES notation for 6-[1-(dimethylamino)-4-methylpentan-2-yl]-5-ethyl-4,6-diazaspiro[2.4]heptan-7-one?
The canonical SMILES for 6-[1-(dimethylamino)-4-methylpentan-2-yl]-5-ethyl-4,6-diazaspiro[2.4]heptan-7-one is CCC1NC2(CC2)C(=O)N1C(CC(C)C)CN(C)C.
What is the InChIKey of 6-[1-(dimethylamino)-4-methylpentan-2-yl]-5-ethyl-4,6-diazaspiro[2.4]heptan-7-one?
The InChIKey is HHDZTYPWCRUMBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-6-13-16-15(7-8-15)14(19)18(13)12(9-11(2)3)10-17(4)5/h11-13,16H,6-10H2,1-5H3.
What are the key properties of 6-[1-(dimethylamino)-4-methylpentan-2-yl]-5-ethyl-4,6-diazaspiro[2.4]heptan-7-one?
6-[1-(dimethylamino)-4-methylpentan-2-yl]-5-ethyl-4,6-diazaspiro[2.4]heptan-7-one has a molecular weight of 267.42 g/mol, XLogP of 1.66, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[1-(dimethylamino)-4-methylpentan-2-yl]-5-ethyl-4,6-diazaspiro[2.4]heptan-7-one is sourced from PubChem (CID 83247410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).