2-cyclopropyl-4-(2-methyl-2,7-diazaspiro[4.5]decane-7-carbonyl)-1H-pyrimidin-6-one

C17H24N4O2 — CID 138035800

IUPAC2-cyclopropyl-4-(2-methyl-2,7-diazaspiro[4.5]decane-7-carbonyl)-1H-pyrimidin-6-one
SMILESCN1CCC2(CCCN(C(=O)c3cc(=O)[nH]c(C4CC4)n3)C2)C1
InChIInChI=1S/C17H24N4O2/c1-20-8-6-17(10-20)5-2-7-21(11-17)16(23)13-9-14(22)19-15(18-13)12-3-4-12/h9,12H,2-8,10-11H2,1H3,(H,18,19,22)
InChIKeyWZVSVLSLMIBTIS-UHFFFAOYSA-N
MW316.40 g/mol
LogP1.21
Rot. Bonds2

About 2-cyclopropyl-4-(2-methyl-2,7-diazaspiro[4.5]decane-7-carbonyl)-1H-pyrimidin-6-one

2-cyclopropyl-4-(2-methyl-2,7-diazaspiro[4.5]decane-7-carbonyl)-1H-pyrimidin-6-one (PubChem CID 138035800) has the molecular formula C17H24N4O2 and a molecular weight of 316.40 g/mol. Its IUPAC name is 2-cyclopropyl-4-(2-methyl-2,7-diazaspiro[4.5]decane-7-carbonyl)-1H-pyrimidin-6-one.

Molecular Properties

Compound Name2-cyclopropyl-4-(2-methyl-2,7-diazaspiro[4.5]decane-7-carbonyl)-1H-pyrimidin-6-one
PubChem CID138035800
Molecular FormulaC17H24N4O2
Molecular Weight316.40 g/mol
Exact Mass316.19
IUPAC Name2-cyclopropyl-4-(2-methyl-2,7-diazaspiro[4.5]decane-7-carbonyl)-1H-pyrimidin-6-one
SMILESCN1CCC2(CCCN(C(=O)c3cc(=O)[nH]c(C4CC4)n3)C2)C1
InChIInChI=1S/C17H24N4O2/c1-20-8-6-17(10-20)5-2-7-21(11-17)16(23)13-9-14(22)19-15(18-13)12-3-4-12/h9,12H,2-8,10-11H2,1H3,(H,18,19,22)
InChIKeyWZVSVLSLMIBTIS-UHFFFAOYSA-N
XLogP1.21
TPSA69.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.40
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-cyclopropyl-4-(2-methyl-2,7-diazaspiro[4.5]decane-7-carbonyl)-1H-pyrimidin-6-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

CID 164633584
CID 164633584
CID 154876455
CID 154876455
CID 137973764
CID 137973764
CID 137978236
CID 137978236
CID 137999875
CID 137999875
CID 138004707
CID 138004707
CID 138004723
CID 138004723
CID 138004724
CID 138004724
CID 138004935
CID 138004935
CID 138005241
CID 138005241
CID 138381762
CID 138381762
CID 154759441
CID 154759441

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-4-(2-methyl-2,7-diazaspiro[4.5]decane-7-carbonyl)-1H-pyrimidin-6-one?
The IUPAC name of 2-cyclopropyl-4-(2-methyl-2,7-diazaspiro[4.5]decane-7-carbonyl)-1H-pyrimidin-6-one (CID 138035800) is 2-cyclopropyl-4-(2-methyl-2,7-diazaspiro[4.5]decane-7-carbonyl)-1H-pyrimidin-6-one.
What is the SMILES notation for 2-cyclopropyl-4-(2-methyl-2,7-diazaspiro[4.5]decane-7-carbonyl)-1H-pyrimidin-6-one?
The canonical SMILES for 2-cyclopropyl-4-(2-methyl-2,7-diazaspiro[4.5]decane-7-carbonyl)-1H-pyrimidin-6-one is CN1CCC2(CCCN(C(=O)c3cc(=O)[nH]c(C4CC4)n3)C2)C1.
What is the InChIKey of 2-cyclopropyl-4-(2-methyl-2,7-diazaspiro[4.5]decane-7-carbonyl)-1H-pyrimidin-6-one?
The InChIKey is WZVSVLSLMIBTIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4O2/c1-20-8-6-17(10-20)5-2-7-21(11-17)16(23)13-9-14(22)19-15(18-13)12-3-4-12/h9,12H,2-8,10-11H2,1H3,(H,18,19,22).
What are the key properties of 2-cyclopropyl-4-(2-methyl-2,7-diazaspiro[4.5]decane-7-carbonyl)-1H-pyrimidin-6-one?
2-cyclopropyl-4-(2-methyl-2,7-diazaspiro[4.5]decane-7-carbonyl)-1H-pyrimidin-6-one has a molecular weight of 316.40 g/mol, XLogP of 1.21, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-4-(2-methyl-2,7-diazaspiro[4.5]decane-7-carbonyl)-1H-pyrimidin-6-one is sourced from PubChem (CID 138035800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).