N-(1-morpholin-4-ylpropan-2-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide

C16H20N4O3 — CID 51081193

IUPACN-(1-morpholin-4-ylpropan-2-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
SMILESCC(CN1CCOCC1)NC(=O)c1cnc2ccccn2c1=O
InChIInChI=1S/C16H20N4O3/c1-12(11-19-6-8-23-9-7-19)18-15(21)13-10-17-14-4-2-3-5-20(14)16(13)22/h2-5,10,12H,6-9,11H2,1H3,(H,18,21)
InChIKeyZBDCXTOWNQISRQ-UHFFFAOYSA-N
MW316.36 g/mol
LogP0.14
Rot. Bonds4

About N-(1-morpholin-4-ylpropan-2-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide

N-(1-morpholin-4-ylpropan-2-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide (PubChem CID 51081193) has the molecular formula C16H20N4O3 and a molecular weight of 316.36 g/mol. Its IUPAC name is N-(1-morpholin-4-ylpropan-2-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound NameN-(1-morpholin-4-ylpropan-2-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
PubChem CID51081193
Molecular FormulaC16H20N4O3
Molecular Weight316.36 g/mol
Exact Mass316.15
IUPAC NameN-(1-morpholin-4-ylpropan-2-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
SMILESCC(CN1CCOCC1)NC(=O)c1cnc2ccccn2c1=O
InChIInChI=1S/C16H20N4O3/c1-12(11-19-6-8-23-9-7-19)18-15(21)13-10-17-14-4-2-3-5-20(14)16(13)22/h2-5,10,12H,6-9,11H2,1H3,(H,18,21)
InChIKeyZBDCXTOWNQISRQ-UHFFFAOYSA-N
XLogP0.14
TPSA75.94 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.36
LogP ≤ 50.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(1-morpholin-4-ylpropan-2-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide?
The IUPAC name of N-(1-morpholin-4-ylpropan-2-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide (CID 51081193) is N-(1-morpholin-4-ylpropan-2-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide.
What is the SMILES notation for N-(1-morpholin-4-ylpropan-2-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide?
The canonical SMILES for N-(1-morpholin-4-ylpropan-2-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide is CC(CN1CCOCC1)NC(=O)c1cnc2ccccn2c1=O.
What is the InChIKey of N-(1-morpholin-4-ylpropan-2-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide?
The InChIKey is ZBDCXTOWNQISRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O3/c1-12(11-19-6-8-23-9-7-19)18-15(21)13-10-17-14-4-2-3-5-20(14)16(13)22/h2-5,10,12H,6-9,11H2,1H3,(H,18,21).
What are the key properties of N-(1-morpholin-4-ylpropan-2-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide?
N-(1-morpholin-4-ylpropan-2-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide has a molecular weight of 316.36 g/mol, XLogP of 0.14, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-morpholin-4-ylpropan-2-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 51081193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).