2-methyl-1-propan-2-yl-3,4-dihydro-2H-pyrimido[1,2-c]pyrimidin-6-one

C11H17N3O — CID 131744660

IUPAC2-methyl-1-propan-2-yl-3,4-dihydro-2H-pyrimido[1,2-c]pyrimidin-6-one
SMILESCC(C)N1c2ccnc(=O)n2CCC1C
InChIInChI=1S/C11H17N3O/c1-8(2)14-9(3)5-7-13-10(14)4-6-12-11(13)15/h4,6,8-9H,5,7H2,1-3H3
InChIKeyBKNLXHWIPOFMCC-UHFFFAOYSA-N
MW207.28 g/mol
LogP1.25
Rot. Bonds1

About 2-methyl-1-propan-2-yl-3,4-dihydro-2H-pyrimido[1,2-c]pyrimidin-6-one

2-methyl-1-propan-2-yl-3,4-dihydro-2H-pyrimido[1,2-c]pyrimidin-6-one (PubChem CID 131744660) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is 2-methyl-1-propan-2-yl-3,4-dihydro-2H-pyrimido[1,2-c]pyrimidin-6-one.

Molecular Properties

Compound Name2-methyl-1-propan-2-yl-3,4-dihydro-2H-pyrimido[1,2-c]pyrimidin-6-one
PubChem CID131744660
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name2-methyl-1-propan-2-yl-3,4-dihydro-2H-pyrimido[1,2-c]pyrimidin-6-one
SMILESCC(C)N1c2ccnc(=O)n2CCC1C
InChIInChI=1S/C11H17N3O/c1-8(2)14-9(3)5-7-13-10(14)4-6-12-11(13)15/h4,6,8-9H,5,7H2,1-3H3
InChIKeyBKNLXHWIPOFMCC-UHFFFAOYSA-N
XLogP1.25
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 51.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-hydroxyethyl)-2,3-dihydroimidazo[1,2-c]pyrimidin-5-one
CID 130124536
(5S)-5-methyl-1-propan-2-ylpyrrolidin-2-one
CID 152785079
5-methyl-1-propan-2-ylimidazolidin-2-one
CID 166718631
2-(4-propan-2-ylpiperidin-1-yl)-1H-pyrimidin-6-one
CID 166901181
2-(2-ethylpyrazol-3-yl)-5-oxo-1-propan-2-ylpyrrolidine-3-carboxylic acid
CID 114557623
2-methyl-[1,3]thiazolo[3,2-c]pyrimidine-3,5-dione
CID 14006296
6-methyl-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidin-4-one
CID 10725517
2-chloro-N-methyl-N-(1-propan-2-ylpiperidin-4-yl)pyridine-4-carboxamide
CID 60725190
2-chloro-4-(1-propan-2-ylpiperidin-4-yl)pyridine
CID 66509908
6-amino-7-(2-methylpyrimidin-4-yl)-1-propan-2-ylazepan-2-one
CID 115529149
4-propan-2-yl-6,7-dihydropyrazolo[1,5-a]pyrimidin-5-one
CID 171846440
(4-propan-2-ylpiperidin-1-yl)-pyrimidin-2-ylmethanone
CID 118902078

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-propan-2-yl-3,4-dihydro-2H-pyrimido[1,2-c]pyrimidin-6-one?
The IUPAC name of 2-methyl-1-propan-2-yl-3,4-dihydro-2H-pyrimido[1,2-c]pyrimidin-6-one (CID 131744660) is 2-methyl-1-propan-2-yl-3,4-dihydro-2H-pyrimido[1,2-c]pyrimidin-6-one.
What is the SMILES notation for 2-methyl-1-propan-2-yl-3,4-dihydro-2H-pyrimido[1,2-c]pyrimidin-6-one?
The canonical SMILES for 2-methyl-1-propan-2-yl-3,4-dihydro-2H-pyrimido[1,2-c]pyrimidin-6-one is CC(C)N1c2ccnc(=O)n2CCC1C.
What is the InChIKey of 2-methyl-1-propan-2-yl-3,4-dihydro-2H-pyrimido[1,2-c]pyrimidin-6-one?
The InChIKey is BKNLXHWIPOFMCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c1-8(2)14-9(3)5-7-13-10(14)4-6-12-11(13)15/h4,6,8-9H,5,7H2,1-3H3.
What are the key properties of 2-methyl-1-propan-2-yl-3,4-dihydro-2H-pyrimido[1,2-c]pyrimidin-6-one?
2-methyl-1-propan-2-yl-3,4-dihydro-2H-pyrimido[1,2-c]pyrimidin-6-one has a molecular weight of 207.28 g/mol, XLogP of 1.25, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-propan-2-yl-3,4-dihydro-2H-pyrimido[1,2-c]pyrimidin-6-one is sourced from PubChem (CID 131744660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).