8-(6-methoxypyrimidin-4-yl)-2-(1-methylpyrazol-4-yl)-2,8-diazaspiro[4.5]decan-1-one

C17H22N6O2 — CID 97449930

IUPAC8-(6-methoxypyrimidin-4-yl)-2-(1-methylpyrazol-4-yl)-2,8-diazaspiro[4.5]decan-1-one
SMILESCOc1cc(N2CCC3(CC2)CCN(c2cnn(C)c2)C3=O)ncn1
InChIInChI=1S/C17H22N6O2/c1-21-11-13(10-20-21)23-8-5-17(16(23)24)3-6-22(7-4-17)14-9-15(25-2)19-12-18-14/h9-12H,3-8H2,1-2H3
InChIKeyQZFYYHHEGTUJFI-UHFFFAOYSA-N
MW342.40 g/mol
LogP1.24
Rot. Bonds3

About 8-(6-methoxypyrimidin-4-yl)-2-(1-methylpyrazol-4-yl)-2,8-diazaspiro[4.5]decan-1-one

8-(6-methoxypyrimidin-4-yl)-2-(1-methylpyrazol-4-yl)-2,8-diazaspiro[4.5]decan-1-one (PubChem CID 97449930) has the molecular formula C17H22N6O2 and a molecular weight of 342.40 g/mol. Its IUPAC name is 8-(6-methoxypyrimidin-4-yl)-2-(1-methylpyrazol-4-yl)-2,8-diazaspiro[4.5]decan-1-one.

Molecular Properties

Compound Name8-(6-methoxypyrimidin-4-yl)-2-(1-methylpyrazol-4-yl)-2,8-diazaspiro[4.5]decan-1-one
PubChem CID97449930
Molecular FormulaC17H22N6O2
Molecular Weight342.40 g/mol
Exact Mass342.18
IUPAC Name8-(6-methoxypyrimidin-4-yl)-2-(1-methylpyrazol-4-yl)-2,8-diazaspiro[4.5]decan-1-one
SMILESCOc1cc(N2CCC3(CC2)CCN(c2cnn(C)c2)C3=O)ncn1
InChIInChI=1S/C17H22N6O2/c1-21-11-13(10-20-21)23-8-5-17(16(23)24)3-6-22(7-4-17)14-9-15(25-2)19-12-18-14/h9-12H,3-8H2,1-2H3
InChIKeyQZFYYHHEGTUJFI-UHFFFAOYSA-N
XLogP1.24
TPSA76.38 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 51.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 8-(6-methoxypyrimidin-4-yl)-2-(1-methylpyrazol-4-yl)-2,8-diazaspiro[4.5]decan-1-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

(3R)-8-(6-methoxypyrimidin-4-yl)-N-(1-methylpyrazol-4-yl)-1-oxa-8-azaspiro[4.5]decan-3-amine
CID 97395886
(5S)-9-(1-methylpyrazole-4-carbonyl)-2-(1-methylpyrazol-4-yl)-2,9-diazaspiro[4.5]decan-1-one
CID 97490395
9-(6-methoxypyrimidin-4-yl)-4-methyl-1-(2-methylpropyl)-1,4,9-triazaspiro[5.5]undecan-5-one
CID 97495906
(5S)-9-[(4-methoxyphenyl)methyl]-2-(1-methylpyrazol-4-yl)-2,9-diazaspiro[4.5]decan-1-one
CID 97372066
2-methoxy-7-(6-methoxypyrimidin-4-yl)-7-azaspiro[3.5]nonane
CID 97451275
8-(3-fluorobenzoyl)-2-(1-methylpyrazol-4-yl)-2,8-diazaspiro[4.5]decan-1-one
CID 155901290
5-[4-(6-methoxypyrimidin-4-yl)piperazin-1-yl]pyridin-2-amine
CID 66318979
(5R)-2-(1-methylpyrazol-4-yl)-9-(3-methyl-2-pyridinyl)-2,9-diazaspiro[4.5]decan-1-one
CID 97412333
2-(1-methylpyrazol-4-yl)-9-(3-methyl-2-pyridinyl)-2,9-diazaspiro[4.5]decan-1-one
CID 131653300
1-[2-(dimethylamino)ethyl]-9-(6-methoxypyrimidin-4-yl)-1,9-diazaspiro[4.6]undecan-2-one
CID 134070979
2-(1-methylpyrazol-4-yl)-7-(oxane-4-carbonyl)-2,7-diazaspiro[4.4]nonan-1-one
CID 131660715
8-(6-methoxypyrimidin-4-yl)-3-pyridin-4-yl-1,8-diazaspiro[4.5]decan-2-one
CID 134072418

Frequently Asked Questions

What is the IUPAC name of 8-(6-methoxypyrimidin-4-yl)-2-(1-methylpyrazol-4-yl)-2,8-diazaspiro[4.5]decan-1-one?
The IUPAC name of 8-(6-methoxypyrimidin-4-yl)-2-(1-methylpyrazol-4-yl)-2,8-diazaspiro[4.5]decan-1-one (CID 97449930) is 8-(6-methoxypyrimidin-4-yl)-2-(1-methylpyrazol-4-yl)-2,8-diazaspiro[4.5]decan-1-one.
What is the SMILES notation for 8-(6-methoxypyrimidin-4-yl)-2-(1-methylpyrazol-4-yl)-2,8-diazaspiro[4.5]decan-1-one?
The canonical SMILES for 8-(6-methoxypyrimidin-4-yl)-2-(1-methylpyrazol-4-yl)-2,8-diazaspiro[4.5]decan-1-one is COc1cc(N2CCC3(CC2)CCN(c2cnn(C)c2)C3=O)ncn1.
What is the InChIKey of 8-(6-methoxypyrimidin-4-yl)-2-(1-methylpyrazol-4-yl)-2,8-diazaspiro[4.5]decan-1-one?
The InChIKey is QZFYYHHEGTUJFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N6O2/c1-21-11-13(10-20-21)23-8-5-17(16(23)24)3-6-22(7-4-17)14-9-15(25-2)19-12-18-14/h9-12H,3-8H2,1-2H3.
What are the key properties of 8-(6-methoxypyrimidin-4-yl)-2-(1-methylpyrazol-4-yl)-2,8-diazaspiro[4.5]decan-1-one?
8-(6-methoxypyrimidin-4-yl)-2-(1-methylpyrazol-4-yl)-2,8-diazaspiro[4.5]decan-1-one has a molecular weight of 342.40 g/mol, XLogP of 1.24, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(6-methoxypyrimidin-4-yl)-2-(1-methylpyrazol-4-yl)-2,8-diazaspiro[4.5]decan-1-one is sourced from PubChem (CID 97449930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).