N-propyl-3-(1,3,5,7-tetramethyl-2,4-dioxopyrido[2,3-d]pyrimidin-6-yl)propanamide

C17H24N4O3 — CID 6622329

IUPACN-propyl-3-(1,3,5,7-tetramethyl-2,4-dioxopyrido[2,3-d]pyrimidin-6-yl)propanamide
SMILESCCCNC(=O)CCc1c(C)nc2c(c1C)c(=O)n(C)c(=O)n2C
InChIInChI=1S/C17H24N4O3/c1-6-9-18-13(22)8-7-12-10(2)14-15(19-11(12)3)20(4)17(24)21(5)16(14)23/h6-9H2,1-5H3,(H,18,22)
InChIKeyQTKHISRQYQTXTK-UHFFFAOYSA-N
MW332.40 g/mol
LogP0.71
Rot. Bonds5

About N-propyl-3-(1,3,5,7-tetramethyl-2,4-dioxopyrido[2,3-d]pyrimidin-6-yl)propanamide

N-propyl-3-(1,3,5,7-tetramethyl-2,4-dioxopyrido[2,3-d]pyrimidin-6-yl)propanamide (PubChem CID 6622329) has the molecular formula C17H24N4O3 and a molecular weight of 332.40 g/mol. Its IUPAC name is N-propyl-3-(1,3,5,7-tetramethyl-2,4-dioxopyrido[2,3-d]pyrimidin-6-yl)propanamide.

Molecular Properties

Compound NameN-propyl-3-(1,3,5,7-tetramethyl-2,4-dioxopyrido[2,3-d]pyrimidin-6-yl)propanamide
PubChem CID6622329
Molecular FormulaC17H24N4O3
Molecular Weight332.40 g/mol
Exact Mass332.18
IUPAC NameN-propyl-3-(1,3,5,7-tetramethyl-2,4-dioxopyrido[2,3-d]pyrimidin-6-yl)propanamide
SMILESCCCNC(=O)CCc1c(C)nc2c(c1C)c(=O)n(C)c(=O)n2C
InChIInChI=1S/C17H24N4O3/c1-6-9-18-13(22)8-7-12-10(2)14-15(19-11(12)3)20(4)17(24)21(5)16(14)23/h6-9H2,1-5H3,(H,18,22)
InChIKeyQTKHISRQYQTXTK-UHFFFAOYSA-N
XLogP0.71
TPSA85.99 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.40
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-propyl-3-(1,3,5,7-tetramethyl-2,4-dioxopyrido[2,3-d]pyrimidin-6-yl)propanamide?
The IUPAC name of N-propyl-3-(1,3,5,7-tetramethyl-2,4-dioxopyrido[2,3-d]pyrimidin-6-yl)propanamide (CID 6622329) is N-propyl-3-(1,3,5,7-tetramethyl-2,4-dioxopyrido[2,3-d]pyrimidin-6-yl)propanamide.
What is the SMILES notation for N-propyl-3-(1,3,5,7-tetramethyl-2,4-dioxopyrido[2,3-d]pyrimidin-6-yl)propanamide?
The canonical SMILES for N-propyl-3-(1,3,5,7-tetramethyl-2,4-dioxopyrido[2,3-d]pyrimidin-6-yl)propanamide is CCCNC(=O)CCc1c(C)nc2c(c1C)c(=O)n(C)c(=O)n2C.
What is the InChIKey of N-propyl-3-(1,3,5,7-tetramethyl-2,4-dioxopyrido[2,3-d]pyrimidin-6-yl)propanamide?
The InChIKey is QTKHISRQYQTXTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4O3/c1-6-9-18-13(22)8-7-12-10(2)14-15(19-11(12)3)20(4)17(24)21(5)16(14)23/h6-9H2,1-5H3,(H,18,22).
What are the key properties of N-propyl-3-(1,3,5,7-tetramethyl-2,4-dioxopyrido[2,3-d]pyrimidin-6-yl)propanamide?
N-propyl-3-(1,3,5,7-tetramethyl-2,4-dioxopyrido[2,3-d]pyrimidin-6-yl)propanamide has a molecular weight of 332.40 g/mol, XLogP of 0.71, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-3-(1,3,5,7-tetramethyl-2,4-dioxopyrido[2,3-d]pyrimidin-6-yl)propanamide is sourced from PubChem (CID 6622329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).