2-hydroxy-8-methyl-N-(2-morpholin-4-ylethyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide

C16H20N4O4 — CID 135681022

IUPAC2-hydroxy-8-methyl-N-(2-morpholin-4-ylethyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
SMILESCc1ccn2c(=O)c(C(=O)NCCN3CCOCC3)c(O)nc2c1
InChIInChI=1S/C16H20N4O4/c1-11-2-4-20-12(10-11)18-15(22)13(16(20)23)14(21)17-3-5-19-6-8-24-9-7-19/h2,4,10,22H,3,5-9H2,1H3,(H,17,21)
InChIKeyDVZTVFGTAUKENV-UHFFFAOYSA-N
MW332.36 g/mol
LogP-0.23
Rot. Bonds4

About 2-hydroxy-8-methyl-N-(2-morpholin-4-ylethyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide

2-hydroxy-8-methyl-N-(2-morpholin-4-ylethyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide (PubChem CID 135681022) has the molecular formula C16H20N4O4 and a molecular weight of 332.36 g/mol. Its IUPAC name is 2-hydroxy-8-methyl-N-(2-morpholin-4-ylethyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound Name2-hydroxy-8-methyl-N-(2-morpholin-4-ylethyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
PubChem CID135681022
Molecular FormulaC16H20N4O4
Molecular Weight332.36 g/mol
Exact Mass332.15
IUPAC Name2-hydroxy-8-methyl-N-(2-morpholin-4-ylethyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
SMILESCc1ccn2c(=O)c(C(=O)NCCN3CCOCC3)c(O)nc2c1
InChIInChI=1S/C16H20N4O4/c1-11-2-4-20-12(10-11)18-15(22)13(16(20)23)14(21)17-3-5-19-6-8-24-9-7-19/h2,4,10,22H,3,5-9H2,1H3,(H,17,21)
InChIKeyDVZTVFGTAUKENV-UHFFFAOYSA-N
XLogP-0.23
TPSA96.17 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.36
LogP ≤ 5-0.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-8-methyl-N-(2-morpholin-4-ylethyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide?
The IUPAC name of 2-hydroxy-8-methyl-N-(2-morpholin-4-ylethyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide (CID 135681022) is 2-hydroxy-8-methyl-N-(2-morpholin-4-ylethyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide.
What is the SMILES notation for 2-hydroxy-8-methyl-N-(2-morpholin-4-ylethyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide?
The canonical SMILES for 2-hydroxy-8-methyl-N-(2-morpholin-4-ylethyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide is Cc1ccn2c(=O)c(C(=O)NCCN3CCOCC3)c(O)nc2c1.
What is the InChIKey of 2-hydroxy-8-methyl-N-(2-morpholin-4-ylethyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide?
The InChIKey is DVZTVFGTAUKENV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O4/c1-11-2-4-20-12(10-11)18-15(22)13(16(20)23)14(21)17-3-5-19-6-8-24-9-7-19/h2,4,10,22H,3,5-9H2,1H3,(H,17,21).
What are the key properties of 2-hydroxy-8-methyl-N-(2-morpholin-4-ylethyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide?
2-hydroxy-8-methyl-N-(2-morpholin-4-ylethyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide has a molecular weight of 332.36 g/mol, XLogP of -0.23, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-8-methyl-N-(2-morpholin-4-ylethyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 135681022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).