1,3,5,7-tetramethyl-6-(3-oxo-3-pyrrolidin-1-ylpropyl)pyrido[2,3-d]pyrimidine-2,4-dione

C18H24N4O3 — CID 20864048

IUPAC1,3,5,7-tetramethyl-6-(3-oxo-3-pyrrolidin-1-ylpropyl)pyrido[2,3-d]pyrimidine-2,4-dione
SMILESCc1nc2c(c(C)c1CCC(=O)N1CCCC1)c(=O)n(C)c(=O)n2C
InChIInChI=1S/C18H24N4O3/c1-11-13(7-8-14(23)22-9-5-6-10-22)12(2)19-16-15(11)17(24)21(4)18(25)20(16)3/h5-10H2,1-4H3
InChIKeyVLKFCIOKSIWPOA-UHFFFAOYSA-N
MW344.42 g/mol
LogP0.80
Rot. Bonds3

About 1,3,5,7-tetramethyl-6-(3-oxo-3-pyrrolidin-1-ylpropyl)pyrido[2,3-d]pyrimidine-2,4-dione

1,3,5,7-tetramethyl-6-(3-oxo-3-pyrrolidin-1-ylpropyl)pyrido[2,3-d]pyrimidine-2,4-dione (PubChem CID 20864048) has the molecular formula C18H24N4O3 and a molecular weight of 344.42 g/mol. Its IUPAC name is 1,3,5,7-tetramethyl-6-(3-oxo-3-pyrrolidin-1-ylpropyl)pyrido[2,3-d]pyrimidine-2,4-dione.

Molecular Properties

Compound Name1,3,5,7-tetramethyl-6-(3-oxo-3-pyrrolidin-1-ylpropyl)pyrido[2,3-d]pyrimidine-2,4-dione
PubChem CID20864048
Molecular FormulaC18H24N4O3
Molecular Weight344.42 g/mol
Exact Mass344.18
IUPAC Name1,3,5,7-tetramethyl-6-(3-oxo-3-pyrrolidin-1-ylpropyl)pyrido[2,3-d]pyrimidine-2,4-dione
SMILESCc1nc2c(c(C)c1CCC(=O)N1CCCC1)c(=O)n(C)c(=O)n2C
InChIInChI=1S/C18H24N4O3/c1-11-13(7-8-14(23)22-9-5-6-10-22)12(2)19-16-15(11)17(24)21(4)18(25)20(16)3/h5-10H2,1-4H3
InChIKeyVLKFCIOKSIWPOA-UHFFFAOYSA-N
XLogP0.80
TPSA77.20 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.42
LogP ≤ 50.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1,3,5,7-tetramethyl-6-(3-oxo-3-pyrrolidin-1-ylpropyl)pyrido[2,3-d]pyrimidine-2,4-dione?
The IUPAC name of 1,3,5,7-tetramethyl-6-(3-oxo-3-pyrrolidin-1-ylpropyl)pyrido[2,3-d]pyrimidine-2,4-dione (CID 20864048) is 1,3,5,7-tetramethyl-6-(3-oxo-3-pyrrolidin-1-ylpropyl)pyrido[2,3-d]pyrimidine-2,4-dione.
What is the SMILES notation for 1,3,5,7-tetramethyl-6-(3-oxo-3-pyrrolidin-1-ylpropyl)pyrido[2,3-d]pyrimidine-2,4-dione?
The canonical SMILES for 1,3,5,7-tetramethyl-6-(3-oxo-3-pyrrolidin-1-ylpropyl)pyrido[2,3-d]pyrimidine-2,4-dione is Cc1nc2c(c(C)c1CCC(=O)N1CCCC1)c(=O)n(C)c(=O)n2C.
What is the InChIKey of 1,3,5,7-tetramethyl-6-(3-oxo-3-pyrrolidin-1-ylpropyl)pyrido[2,3-d]pyrimidine-2,4-dione?
The InChIKey is VLKFCIOKSIWPOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O3/c1-11-13(7-8-14(23)22-9-5-6-10-22)12(2)19-16-15(11)17(24)21(4)18(25)20(16)3/h5-10H2,1-4H3.
What are the key properties of 1,3,5,7-tetramethyl-6-(3-oxo-3-pyrrolidin-1-ylpropyl)pyrido[2,3-d]pyrimidine-2,4-dione?
1,3,5,7-tetramethyl-6-(3-oxo-3-pyrrolidin-1-ylpropyl)pyrido[2,3-d]pyrimidine-2,4-dione has a molecular weight of 344.42 g/mol, XLogP of 0.80, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3,5,7-tetramethyl-6-(3-oxo-3-pyrrolidin-1-ylpropyl)pyrido[2,3-d]pyrimidine-2,4-dione is sourced from PubChem (CID 20864048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).