1-ethyl-3-methyl-1,3,8-triazaspiro[4.5]decan-2-one

C10H19N3O — CID 83880171

IUPAC1-ethyl-3-methyl-1,3,8-triazaspiro[4.5]decan-2-one
SMILESCCN1C(=O)N(C)CC12CCNCC2
InChIInChI=1S/C10H19N3O/c1-3-13-9(14)12(2)8-10(13)4-6-11-7-5-10/h11H,3-8H2,1-2H3
InChIKeyOGQFVDOGOXDDEY-UHFFFAOYSA-N
MW197.28 g/mol
LogP0.50
Rot. Bonds1

About 1-ethyl-3-methyl-1,3,8-triazaspiro[4.5]decan-2-one

1-ethyl-3-methyl-1,3,8-triazaspiro[4.5]decan-2-one (PubChem CID 83880171) has the molecular formula C10H19N3O and a molecular weight of 197.28 g/mol. Its IUPAC name is 1-ethyl-3-methyl-1,3,8-triazaspiro[4.5]decan-2-one.

Molecular Properties

Compound Name1-ethyl-3-methyl-1,3,8-triazaspiro[4.5]decan-2-one
PubChem CID83880171
Molecular FormulaC10H19N3O
Molecular Weight197.28 g/mol
Exact Mass197.15
IUPAC Name1-ethyl-3-methyl-1,3,8-triazaspiro[4.5]decan-2-one
SMILESCCN1C(=O)N(C)CC12CCNCC2
InChIInChI=1S/C10H19N3O/c1-3-13-9(14)12(2)8-10(13)4-6-11-7-5-10/h11H,3-8H2,1-2H3
InChIKeyOGQFVDOGOXDDEY-UHFFFAOYSA-N
XLogP0.50
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 50.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-methyl-1-propan-2-yl-1,3,8-triazaspiro[4.5]decan-2-one
CID 83885529
2-methyl-2,7-diazaspiro[3.5]nonan-3-one;hydrochloride
CID 135392414
1-methyl-1,8-diazaspiro[4.5]decan-2-one
CID 66570377
3-ethyl-3,9-diazaspiro[5.5]undecane-2,4-dione
CID 20622599
ethane;1-ethyl-1,7-diazaspiro[3.5]nonane
CID 156709724
1-methyl-1,4,9-triazaspiro[5.5]undecan-3-one
CID 82407055
5-propyl-5,7-diazaspiro[3.5]nonan-6-one
CID 178099501
1-ethylspiro[3H-quinazoline-2,4'-piperidine]-4-one
CID 53337683
4-methyl-1-oxa-4,9-diazaspiro[5.5]undecan-3-one;hydrochloride
CID 75531160
1',3'-diethylspiro[8-azabicyclo[3.2.1]octane-3,4'-imidazolidine]-2'-one
CID 59827762
1-(2,2,2-trifluoroethyl)-1,3,8-triazaspiro[4.5]decan-2-one
CID 83897503
6-propylspiro[imidazo[1,2-c]imidazole-7,4'-piperidine]-5-one
CID 154575046

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-methyl-1,3,8-triazaspiro[4.5]decan-2-one?
The IUPAC name of 1-ethyl-3-methyl-1,3,8-triazaspiro[4.5]decan-2-one (CID 83880171) is 1-ethyl-3-methyl-1,3,8-triazaspiro[4.5]decan-2-one.
What is the SMILES notation for 1-ethyl-3-methyl-1,3,8-triazaspiro[4.5]decan-2-one?
The canonical SMILES for 1-ethyl-3-methyl-1,3,8-triazaspiro[4.5]decan-2-one is CCN1C(=O)N(C)CC12CCNCC2.
What is the InChIKey of 1-ethyl-3-methyl-1,3,8-triazaspiro[4.5]decan-2-one?
The InChIKey is OGQFVDOGOXDDEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O/c1-3-13-9(14)12(2)8-10(13)4-6-11-7-5-10/h11H,3-8H2,1-2H3.
What are the key properties of 1-ethyl-3-methyl-1,3,8-triazaspiro[4.5]decan-2-one?
1-ethyl-3-methyl-1,3,8-triazaspiro[4.5]decan-2-one has a molecular weight of 197.28 g/mol, XLogP of 0.50, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-methyl-1,3,8-triazaspiro[4.5]decan-2-one is sourced from PubChem (CID 83880171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).