4-amino-8-ethyl-1-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one

C13H23N3O — CID 79967294

IUPAC4-amino-8-ethyl-1-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one
SMILESCCC1CCC2(CC1)C(N)=NC(=O)N2C(C)C
InChIInChI=1S/C13H23N3O/c1-4-10-5-7-13(8-6-10)11(14)15-12(17)16(13)9(2)3/h9-10H,4-8H2,1-3H3,(H2,14,15,17)
InChIKeyFFWARAFTLLGTDX-UHFFFAOYSA-N
MW237.35 g/mol
LogP2.53
Rot. Bonds2

About 4-amino-8-ethyl-1-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one

4-amino-8-ethyl-1-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one (PubChem CID 79967294) has the molecular formula C13H23N3O and a molecular weight of 237.35 g/mol. Its IUPAC name is 4-amino-8-ethyl-1-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one.

Molecular Properties

Compound Name4-amino-8-ethyl-1-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one
PubChem CID79967294
Molecular FormulaC13H23N3O
Molecular Weight237.35 g/mol
Exact Mass237.18
IUPAC Name4-amino-8-ethyl-1-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one
SMILESCCC1CCC2(CC1)C(N)=NC(=O)N2C(C)C
InChIInChI=1S/C13H23N3O/c1-4-10-5-7-13(8-6-10)11(14)15-12(17)16(13)9(2)3/h9-10H,4-8H2,1-3H3,(H2,14,15,17)
InChIKeyFFWARAFTLLGTDX-UHFFFAOYSA-N
XLogP2.53
TPSA58.69 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-amino-8-ethyl-1-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-amino-8-ethyl-1-propan-2-yl-1,3-diazaspiro[4.4]non-3-en-2-one
CID 79967026
4-amino-1-but-3-yn-2-yl-8-ethyl-1,3-diazaspiro[4.6]undec-3-en-2-one
CID 114420905
4-amino-1,8-diethyl-1,3-diazaspiro[4.5]dec-3-en-2-one
CID 79961824
4-amino-1-propan-2-yl-8-(trifluoromethyl)-1,3-diazaspiro[4.5]dec-3-en-2-one
CID 79968155
4-amino-1-propan-2-yl-7-oxa-1,3-diazaspiro[4.4]non-3-en-2-one
CID 79967305
4-amino-7-methyl-1-propan-2-yl-1,3,7-triazaspiro[4.4]non-3-en-2-one
CID 79967212
4-amino-1-(cyclopropylmethyl)-8-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one
CID 79967350
4-amino-7-ethyl-7-methyl-1-propan-2-yl-8-oxa-1,3-diazaspiro[4.5]dec-3-en-2-one
CID 79968352
4-amino-1-methyl-8-propyl-1,3-diazaspiro[4.5]dec-3-en-2-one
CID 79959923
4-amino-1,7-di(propan-2-yl)-8-oxa-1,3-diazaspiro[4.5]dec-3-en-2-one
CID 79967403
4-amino-1-cyclopropyl-7-ethyl-1,3-diazaspiro[4.5]dec-3-en-2-one
CID 79961206
4-amino-1-ethyl-8-methyl-1,3-diazaspiro[4.5]dec-3-en-2-one
CID 79967912

Frequently Asked Questions

What is the IUPAC name of 4-amino-8-ethyl-1-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one?
The IUPAC name of 4-amino-8-ethyl-1-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one (CID 79967294) is 4-amino-8-ethyl-1-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one.
What is the SMILES notation for 4-amino-8-ethyl-1-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one?
The canonical SMILES for 4-amino-8-ethyl-1-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one is CCC1CCC2(CC1)C(N)=NC(=O)N2C(C)C.
What is the InChIKey of 4-amino-8-ethyl-1-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one?
The InChIKey is FFWARAFTLLGTDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O/c1-4-10-5-7-13(8-6-10)11(14)15-12(17)16(13)9(2)3/h9-10H,4-8H2,1-3H3,(H2,14,15,17).
What are the key properties of 4-amino-8-ethyl-1-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one?
4-amino-8-ethyl-1-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one has a molecular weight of 237.35 g/mol, XLogP of 2.53, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-8-ethyl-1-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one is sourced from PubChem (CID 79967294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).