6-[(10-hydroxy-7-methyl-7-azaspiro[4.5]decan-10-yl)methyl]pyrido[4,3-d]pyrimidin-5-one

C18H24N4O2 — CID 139375812

IUPAC6-[(10-hydroxy-7-methyl-7-azaspiro[4.5]decan-10-yl)methyl]pyrido[4,3-d]pyrimidin-5-one
SMILESCN1CCC(O)(Cn2ccc3ncncc3c2=O)C2(CCCC2)C1
InChIInChI=1S/C18H24N4O2/c1-21-9-7-18(24,17(11-21)5-2-3-6-17)12-22-8-4-15-14(16(22)23)10-19-13-20-15/h4,8,10,13,24H,2-3,5-7,9,11-12H2,1H3
InChIKeyKBRXKFIZECMYGV-UHFFFAOYSA-N
MW328.42 g/mol
LogP1.42
Rot. Bonds2

About 6-[(10-hydroxy-7-methyl-7-azaspiro[4.5]decan-10-yl)methyl]pyrido[4,3-d]pyrimidin-5-one

6-[(10-hydroxy-7-methyl-7-azaspiro[4.5]decan-10-yl)methyl]pyrido[4,3-d]pyrimidin-5-one (PubChem CID 139375812) has the molecular formula C18H24N4O2 and a molecular weight of 328.42 g/mol. Its IUPAC name is 6-[(10-hydroxy-7-methyl-7-azaspiro[4.5]decan-10-yl)methyl]pyrido[4,3-d]pyrimidin-5-one.

Molecular Properties

Compound Name6-[(10-hydroxy-7-methyl-7-azaspiro[4.5]decan-10-yl)methyl]pyrido[4,3-d]pyrimidin-5-one
PubChem CID139375812
Molecular FormulaC18H24N4O2
Molecular Weight328.42 g/mol
Exact Mass328.19
IUPAC Name6-[(10-hydroxy-7-methyl-7-azaspiro[4.5]decan-10-yl)methyl]pyrido[4,3-d]pyrimidin-5-one
SMILESCN1CCC(O)(Cn2ccc3ncncc3c2=O)C2(CCCC2)C1
InChIInChI=1S/C18H24N4O2/c1-21-9-7-18(24,17(11-21)5-2-3-6-17)12-22-8-4-15-14(16(22)23)10-19-13-20-15/h4,8,10,13,24H,2-3,5-7,9,11-12H2,1H3
InChIKeyKBRXKFIZECMYGV-UHFFFAOYSA-N
XLogP1.42
TPSA71.25 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.42
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 6-[(10-hydroxy-7-methyl-7-azaspiro[4.5]decan-10-yl)methyl]pyrido[4,3-d]pyrimidin-5-one with MolForge

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Related Compounds

3-[(10-hydroxy-7-methyl-7-azaspiro[4.5]decan-10-yl)methyl]-6-pyridin-3-ylpyrimidin-4-one
CID 139375447
3-[(10-hydroxy-7-methyl-7-azaspiro[4.5]decan-10-yl)methyl]-6-(1-methylpyrazol-4-yl)pyrimidin-4-one
CID 154926893
6-(cycloheptylmethyl)pyrido[4,3-d]pyrimidin-5-one
CID 99799024
6-methylpyrido[4,3-d]pyrimidin-5-one
CID 130723333
6-[[10-hydroxy-7-(4,4,4-trifluorobutanoyl)-7-azaspiro[4.5]decan-10-yl]methyl]-2-morpholin-4-ylpyrido[4,3-d]pyrimidin-5-one
CID 139375524
2-[[10-hydroxy-7-[(3R)-3-phenylmorpholine-4-carbonyl]-7-azaspiro[4.5]decan-10-yl]methyl]-2,7-naphthyridin-1-one
CID 139369965
4-[(10-hydroxy-7-methyl-7-azaspiro[4.5]decan-10-yl)methyl]morpholin-3-one
CID 139375405
2-[[10-hydroxy-7-[(2R)-4,4,4-trifluoro-2-methylbutanoyl]-7-azaspiro[4.5]decan-10-yl]methyl]-7-methoxyisoquinolin-1-one
CID 139370369
10-hydroxy-10-[(2-methylsulfanyl-5-oxopyrimido[4,5-d]pyrimidin-6-yl)methyl]-7-azaspiro[4.5]decane-7-carboxylic acid
CID 139369985
2-[[7-(3-cyclohexyl-2-methylpropanoyl)-10-hydroxy-7-azaspiro[4.5]decan-10-yl]methyl]-7-fluoroisoquinolin-1-one
CID 139369978
2-[[10-hydroxy-7-(4,4,4-trifluorobutanoyl)-7-azaspiro[4.5]decan-10-yl]methyl]-6-(trifluoromethyl)isoquinolin-1-one
CID 167255660
7-chloro-3-[[10-hydroxy-7-(4,4,4-trifluorobutanoyl)-7-azaspiro[4.5]decan-10-yl]methyl]quinazolin-4-one
CID 167256111

Frequently Asked Questions

What is the IUPAC name of 6-[(10-hydroxy-7-methyl-7-azaspiro[4.5]decan-10-yl)methyl]pyrido[4,3-d]pyrimidin-5-one?
The IUPAC name of 6-[(10-hydroxy-7-methyl-7-azaspiro[4.5]decan-10-yl)methyl]pyrido[4,3-d]pyrimidin-5-one (CID 139375812) is 6-[(10-hydroxy-7-methyl-7-azaspiro[4.5]decan-10-yl)methyl]pyrido[4,3-d]pyrimidin-5-one.
What is the SMILES notation for 6-[(10-hydroxy-7-methyl-7-azaspiro[4.5]decan-10-yl)methyl]pyrido[4,3-d]pyrimidin-5-one?
The canonical SMILES for 6-[(10-hydroxy-7-methyl-7-azaspiro[4.5]decan-10-yl)methyl]pyrido[4,3-d]pyrimidin-5-one is CN1CCC(O)(Cn2ccc3ncncc3c2=O)C2(CCCC2)C1.
What is the InChIKey of 6-[(10-hydroxy-7-methyl-7-azaspiro[4.5]decan-10-yl)methyl]pyrido[4,3-d]pyrimidin-5-one?
The InChIKey is KBRXKFIZECMYGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O2/c1-21-9-7-18(24,17(11-21)5-2-3-6-17)12-22-8-4-15-14(16(22)23)10-19-13-20-15/h4,8,10,13,24H,2-3,5-7,9,11-12H2,1H3.
What are the key properties of 6-[(10-hydroxy-7-methyl-7-azaspiro[4.5]decan-10-yl)methyl]pyrido[4,3-d]pyrimidin-5-one?
6-[(10-hydroxy-7-methyl-7-azaspiro[4.5]decan-10-yl)methyl]pyrido[4,3-d]pyrimidin-5-one has a molecular weight of 328.42 g/mol, XLogP of 1.42, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(10-hydroxy-7-methyl-7-azaspiro[4.5]decan-10-yl)methyl]pyrido[4,3-d]pyrimidin-5-one is sourced from PubChem (CID 139375812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).