3-[(4R)-4-amino-8-azaspiro[4.5]decan-8-yl]-6-propan-2-yl-1H-pyrazin-2-one

C16H26N4O — CID 139525956

IUPAC3-[(4R)-4-amino-8-azaspiro[4.5]decan-8-yl]-6-propan-2-yl-1H-pyrazin-2-one
SMILESCC(C)c1cnc(N2CCC3(CCC[C@H]3N)CC2)c(=O)[nH]1
InChIInChI=1S/C16H26N4O/c1-11(2)12-10-18-14(15(21)19-12)20-8-6-16(7-9-20)5-3-4-13(16)17/h10-11,13H,3-9,17H2,1-2H3,(H,19,21)/t13-/m1/s1
InChIKeyUTYFUWXDUXSWPI-CYBMUJFWSA-N
MW290.41 g/mol
LogP1.99
Rot. Bonds2

About 3-[(4R)-4-amino-8-azaspiro[4.5]decan-8-yl]-6-propan-2-yl-1H-pyrazin-2-one

3-[(4R)-4-amino-8-azaspiro[4.5]decan-8-yl]-6-propan-2-yl-1H-pyrazin-2-one (PubChem CID 139525956) has the molecular formula C16H26N4O and a molecular weight of 290.41 g/mol. Its IUPAC name is 3-[(4R)-4-amino-8-azaspiro[4.5]decan-8-yl]-6-propan-2-yl-1H-pyrazin-2-one.

Molecular Properties

Compound Name3-[(4R)-4-amino-8-azaspiro[4.5]decan-8-yl]-6-propan-2-yl-1H-pyrazin-2-one
PubChem CID139525956
Molecular FormulaC16H26N4O
Molecular Weight290.41 g/mol
Exact Mass290.21
IUPAC Name3-[(4R)-4-amino-8-azaspiro[4.5]decan-8-yl]-6-propan-2-yl-1H-pyrazin-2-one
SMILESCC(C)c1cnc(N2CCC3(CCC[C@H]3N)CC2)c(=O)[nH]1
InChIInChI=1S/C16H26N4O/c1-11(2)12-10-18-14(15(21)19-12)20-8-6-16(7-9-20)5-3-4-13(16)17/h10-11,13H,3-9,17H2,1-2H3,(H,19,21)/t13-/m1/s1
InChIKeyUTYFUWXDUXSWPI-CYBMUJFWSA-N
XLogP1.99
TPSA75.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-[(4R)-4-amino-8-azaspiro[4.5]decan-8-yl]-6-propan-2-yl-1H-pyrazin-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

Frequently Asked Questions

What is the IUPAC name of 3-[(4R)-4-amino-8-azaspiro[4.5]decan-8-yl]-6-propan-2-yl-1H-pyrazin-2-one?
The IUPAC name of 3-[(4R)-4-amino-8-azaspiro[4.5]decan-8-yl]-6-propan-2-yl-1H-pyrazin-2-one (CID 139525956) is 3-[(4R)-4-amino-8-azaspiro[4.5]decan-8-yl]-6-propan-2-yl-1H-pyrazin-2-one.
What is the SMILES notation for 3-[(4R)-4-amino-8-azaspiro[4.5]decan-8-yl]-6-propan-2-yl-1H-pyrazin-2-one?
The canonical SMILES for 3-[(4R)-4-amino-8-azaspiro[4.5]decan-8-yl]-6-propan-2-yl-1H-pyrazin-2-one is CC(C)c1cnc(N2CCC3(CCC[C@H]3N)CC2)c(=O)[nH]1.
What is the InChIKey of 3-[(4R)-4-amino-8-azaspiro[4.5]decan-8-yl]-6-propan-2-yl-1H-pyrazin-2-one?
The InChIKey is UTYFUWXDUXSWPI-CYBMUJFWSA-N. The full InChI is InChI=1S/C16H26N4O/c1-11(2)12-10-18-14(15(21)19-12)20-8-6-16(7-9-20)5-3-4-13(16)17/h10-11,13H,3-9,17H2,1-2H3,(H,19,21)/t13-/m1/s1.
What are the key properties of 3-[(4R)-4-amino-8-azaspiro[4.5]decan-8-yl]-6-propan-2-yl-1H-pyrazin-2-one?
3-[(4R)-4-amino-8-azaspiro[4.5]decan-8-yl]-6-propan-2-yl-1H-pyrazin-2-one has a molecular weight of 290.41 g/mol, XLogP of 1.99, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4R)-4-amino-8-azaspiro[4.5]decan-8-yl]-6-propan-2-yl-1H-pyrazin-2-one is sourced from PubChem (CID 139525956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).