7-methyl-2-(2-methylimidazo[1,2-a]pyrimidine-3-carbonyl)-2,7-diazaspiro[4.5]decan-6-one

C17H21N5O2 — CID 56902744

IUPAC7-methyl-2-(2-methylimidazo[1,2-a]pyrimidine-3-carbonyl)-2,7-diazaspiro[4.5]decan-6-one
SMILESCc1nc2ncccn2c1C(=O)N1CCC2(CCCN(C)C2=O)C1
InChIInChI=1S/C17H21N5O2/c1-12-13(22-9-4-7-18-16(22)19-12)14(23)21-10-6-17(11-21)5-3-8-20(2)15(17)24/h4,7,9H,3,5-6,8,10-11H2,1-2H3
InChIKeyUTHFYSPAAFMSNM-UHFFFAOYSA-N
MW327.39 g/mol
LogP1.12
Rot. Bonds1

About 7-methyl-2-(2-methylimidazo[1,2-a]pyrimidine-3-carbonyl)-2,7-diazaspiro[4.5]decan-6-one

7-methyl-2-(2-methylimidazo[1,2-a]pyrimidine-3-carbonyl)-2,7-diazaspiro[4.5]decan-6-one (PubChem CID 56902744) has the molecular formula C17H21N5O2 and a molecular weight of 327.39 g/mol. Its IUPAC name is 7-methyl-2-(2-methylimidazo[1,2-a]pyrimidine-3-carbonyl)-2,7-diazaspiro[4.5]decan-6-one.

Molecular Properties

Compound Name7-methyl-2-(2-methylimidazo[1,2-a]pyrimidine-3-carbonyl)-2,7-diazaspiro[4.5]decan-6-one
PubChem CID56902744
Molecular FormulaC17H21N5O2
Molecular Weight327.39 g/mol
Exact Mass327.17
IUPAC Name7-methyl-2-(2-methylimidazo[1,2-a]pyrimidine-3-carbonyl)-2,7-diazaspiro[4.5]decan-6-one
SMILESCc1nc2ncccn2c1C(=O)N1CCC2(CCCN(C)C2=O)C1
InChIInChI=1S/C17H21N5O2/c1-12-13(22-9-4-7-18-16(22)19-12)14(23)21-10-6-17(11-21)5-3-8-20(2)15(17)24/h4,7,9H,3,5-6,8,10-11H2,1-2H3
InChIKeyUTHFYSPAAFMSNM-UHFFFAOYSA-N
XLogP1.12
TPSA70.81 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.39
LogP ≤ 51.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-methyl-2-(2-methylimidazo[1,2-a]pyrimidine-3-carbonyl)-2,7-diazaspiro[4.5]decan-6-one?
The IUPAC name of 7-methyl-2-(2-methylimidazo[1,2-a]pyrimidine-3-carbonyl)-2,7-diazaspiro[4.5]decan-6-one (CID 56902744) is 7-methyl-2-(2-methylimidazo[1,2-a]pyrimidine-3-carbonyl)-2,7-diazaspiro[4.5]decan-6-one.
What is the SMILES notation for 7-methyl-2-(2-methylimidazo[1,2-a]pyrimidine-3-carbonyl)-2,7-diazaspiro[4.5]decan-6-one?
The canonical SMILES for 7-methyl-2-(2-methylimidazo[1,2-a]pyrimidine-3-carbonyl)-2,7-diazaspiro[4.5]decan-6-one is Cc1nc2ncccn2c1C(=O)N1CCC2(CCCN(C)C2=O)C1.
What is the InChIKey of 7-methyl-2-(2-methylimidazo[1,2-a]pyrimidine-3-carbonyl)-2,7-diazaspiro[4.5]decan-6-one?
The InChIKey is UTHFYSPAAFMSNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N5O2/c1-12-13(22-9-4-7-18-16(22)19-12)14(23)21-10-6-17(11-21)5-3-8-20(2)15(17)24/h4,7,9H,3,5-6,8,10-11H2,1-2H3.
What are the key properties of 7-methyl-2-(2-methylimidazo[1,2-a]pyrimidine-3-carbonyl)-2,7-diazaspiro[4.5]decan-6-one?
7-methyl-2-(2-methylimidazo[1,2-a]pyrimidine-3-carbonyl)-2,7-diazaspiro[4.5]decan-6-one has a molecular weight of 327.39 g/mol, XLogP of 1.12, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-2-(2-methylimidazo[1,2-a]pyrimidine-3-carbonyl)-2,7-diazaspiro[4.5]decan-6-one is sourced from PubChem (CID 56902744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).