2,7-di(propan-2-yl)pyrido[1,2-c]pyrimidine-1,3-dione

C14H18N2O2 — CID 58748047

IUPAC2,7-di(propan-2-yl)pyrido[1,2-c]pyrimidine-1,3-dione
SMILESCC(C)c1ccc2cc(=O)n(C(C)C)c(=O)n2c1
InChIInChI=1S/C14H18N2O2/c1-9(2)11-5-6-12-7-13(17)16(10(3)4)14(18)15(12)8-11/h5-10H,1-4H3
InChIKeyQHHPDUOTLIRBFQ-UHFFFAOYSA-N
MW246.31 g/mol
LogP2.17
Rot. Bonds2

About 2,7-di(propan-2-yl)pyrido[1,2-c]pyrimidine-1,3-dione

2,7-di(propan-2-yl)pyrido[1,2-c]pyrimidine-1,3-dione (PubChem CID 58748047) has the molecular formula C14H18N2O2 and a molecular weight of 246.31 g/mol. Its IUPAC name is 2,7-di(propan-2-yl)pyrido[1,2-c]pyrimidine-1,3-dione.

Molecular Properties

Compound Name2,7-di(propan-2-yl)pyrido[1,2-c]pyrimidine-1,3-dione
PubChem CID58748047
Molecular FormulaC14H18N2O2
Molecular Weight246.31 g/mol
Exact Mass246.14
IUPAC Name2,7-di(propan-2-yl)pyrido[1,2-c]pyrimidine-1,3-dione
SMILESCC(C)c1ccc2cc(=O)n(C(C)C)c(=O)n2c1
InChIInChI=1S/C14H18N2O2/c1-9(2)11-5-6-12-7-13(17)16(10(3)4)14(18)15(12)8-11/h5-10H,1-4H3
InChIKeyQHHPDUOTLIRBFQ-UHFFFAOYSA-N
XLogP2.17
TPSA43.48 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 52.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,7-di(propan-2-yl)pyrido[1,2-c]pyrimidine-1,3-dione?
The IUPAC name of 2,7-di(propan-2-yl)pyrido[1,2-c]pyrimidine-1,3-dione (CID 58748047) is 2,7-di(propan-2-yl)pyrido[1,2-c]pyrimidine-1,3-dione.
What is the SMILES notation for 2,7-di(propan-2-yl)pyrido[1,2-c]pyrimidine-1,3-dione?
The canonical SMILES for 2,7-di(propan-2-yl)pyrido[1,2-c]pyrimidine-1,3-dione is CC(C)c1ccc2cc(=O)n(C(C)C)c(=O)n2c1.
What is the InChIKey of 2,7-di(propan-2-yl)pyrido[1,2-c]pyrimidine-1,3-dione?
The InChIKey is QHHPDUOTLIRBFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2/c1-9(2)11-5-6-12-7-13(17)16(10(3)4)14(18)15(12)8-11/h5-10H,1-4H3.
What are the key properties of 2,7-di(propan-2-yl)pyrido[1,2-c]pyrimidine-1,3-dione?
2,7-di(propan-2-yl)pyrido[1,2-c]pyrimidine-1,3-dione has a molecular weight of 246.31 g/mol, XLogP of 2.17, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,7-di(propan-2-yl)pyrido[1,2-c]pyrimidine-1,3-dione is sourced from PubChem (CID 58748047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).