7-(5-ethyl-6-methoxy-3-pyridinyl)-3-(2-morpholin-4-ylethoxy)pyrido[1,2-a]pyrimidin-4-one

C22H26N4O4 — CID 129134184

IUPAC7-(5-ethyl-6-methoxy-3-pyridinyl)-3-(2-morpholin-4-ylethoxy)pyrido[1,2-a]pyrimidin-4-one
SMILESCCc1cc(-c2ccc3ncc(OCCN4CCOCC4)c(=O)n3c2)cnc1OC
InChIInChI=1S/C22H26N4O4/c1-3-16-12-18(13-24-21(16)28-2)17-4-5-20-23-14-19(22(27)26(20)15-17)30-11-8-25-6-9-29-10-7-25/h4-5,12-15H,3,6-11H2,1-2H3
InChIKeyDPJUFOSNCOSICD-UHFFFAOYSA-N
MW410.47 g/mol
LogP2.04
Rot. Bonds7

About 7-(5-ethyl-6-methoxy-3-pyridinyl)-3-(2-morpholin-4-ylethoxy)pyrido[1,2-a]pyrimidin-4-one

7-(5-ethyl-6-methoxy-3-pyridinyl)-3-(2-morpholin-4-ylethoxy)pyrido[1,2-a]pyrimidin-4-one (PubChem CID 129134184) has the molecular formula C22H26N4O4 and a molecular weight of 410.47 g/mol. Its IUPAC name is 7-(5-ethyl-6-methoxy-3-pyridinyl)-3-(2-morpholin-4-ylethoxy)pyrido[1,2-a]pyrimidin-4-one.

Molecular Properties

Compound Name7-(5-ethyl-6-methoxy-3-pyridinyl)-3-(2-morpholin-4-ylethoxy)pyrido[1,2-a]pyrimidin-4-one
PubChem CID129134184
Molecular FormulaC22H26N4O4
Molecular Weight410.47 g/mol
Exact Mass410.20
IUPAC Name7-(5-ethyl-6-methoxy-3-pyridinyl)-3-(2-morpholin-4-ylethoxy)pyrido[1,2-a]pyrimidin-4-one
SMILESCCc1cc(-c2ccc3ncc(OCCN4CCOCC4)c(=O)n3c2)cnc1OC
InChIInChI=1S/C22H26N4O4/c1-3-16-12-18(13-24-21(16)28-2)17-4-5-20-23-14-19(22(27)26(20)15-17)30-11-8-25-6-9-29-10-7-25/h4-5,12-15H,3,6-11H2,1-2H3
InChIKeyDPJUFOSNCOSICD-UHFFFAOYSA-N
XLogP2.04
TPSA78.19 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.47
LogP ≤ 52.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 7-(5-ethyl-6-methoxy-3-pyridinyl)-3-(2-morpholin-4-ylethoxy)pyrido[1,2-a]pyrimidin-4-one with MolForge

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Launch Full Analysis

Related Compounds

N-tert-butyl-2-[2-methoxy-5-[3-(2-morpholin-4-ylethoxy)-4-oxopyrido[1,2-a]pyrimidin-7-yl]-3-pyridinyl]acetamide
CID 140786105
2-chloro-4-fluoro-N-[2-methoxy-5-[3-(2-morpholin-4-ylethoxy)-4-oxopyrido[1,2-a]pyrimidin-7-yl]-3-pyridinyl]-2-methylcyclohexane-1-sulfonamide
CID 139417819
2-chloro-4-fluoro-N-[2-methoxy-5-[3-[2-(4-methylpiperazin-1-yl)ethoxy]-4-oxopyrido[1,2-a]pyrimidin-7-yl]-3-pyridinyl]benzenesulfonamide
CID 118613133
2-chloro-N-[5-[3-[2-(2,6-dimethylmorpholin-4-yl)ethoxy]-4-oxopyrido[1,2-a]pyrimidin-7-yl]-2-methoxy-3-pyridinyl]-4-fluorobenzenesulfonamide
CID 139417865
N-[2-methoxy-5-[3-(2-methoxyethoxy)-4-oxopyrido[1,2-a]pyrimidin-7-yl]-3-pyridinyl]-3-methylthiophene-2-sulfonamide
CID 118617112
4-[2-[[5-(4-methylphenyl)-2-pyridinyl]oxy]ethyl]morpholine
CID 126471082
4-[2-[4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenoxy]ethyl]morpholine
CID 134179285
N-[5-[3-[2-(dimethylamino)ethoxy]-4-oxopyrido[1,2-a]pyrimidin-7-yl]-2-methoxy-3-pyridinyl]-3-methylthiophene-2-sulfonamide
CID 118613278
4-[2-[4-(6-ethyl-3-pyridinyl)phenoxy]ethyl]morpholine
CID 59845977
4-[2-[4-[3-(3,4-dimethoxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-6-yl]pyrazol-1-yl]ethyl]morpholine
CID 162645311
4-[6-(2-morpholin-4-ylethoxy)imidazo[1,2-b]pyridazin-3-yl]phenol
CID 176715164
4-methoxy-3-(2-morpholin-4-ylethoxy)benzaldehyde
CID 3251033

Frequently Asked Questions

What is the IUPAC name of 7-(5-ethyl-6-methoxy-3-pyridinyl)-3-(2-morpholin-4-ylethoxy)pyrido[1,2-a]pyrimidin-4-one?
The IUPAC name of 7-(5-ethyl-6-methoxy-3-pyridinyl)-3-(2-morpholin-4-ylethoxy)pyrido[1,2-a]pyrimidin-4-one (CID 129134184) is 7-(5-ethyl-6-methoxy-3-pyridinyl)-3-(2-morpholin-4-ylethoxy)pyrido[1,2-a]pyrimidin-4-one.
What is the SMILES notation for 7-(5-ethyl-6-methoxy-3-pyridinyl)-3-(2-morpholin-4-ylethoxy)pyrido[1,2-a]pyrimidin-4-one?
The canonical SMILES for 7-(5-ethyl-6-methoxy-3-pyridinyl)-3-(2-morpholin-4-ylethoxy)pyrido[1,2-a]pyrimidin-4-one is CCc1cc(-c2ccc3ncc(OCCN4CCOCC4)c(=O)n3c2)cnc1OC.
What is the InChIKey of 7-(5-ethyl-6-methoxy-3-pyridinyl)-3-(2-morpholin-4-ylethoxy)pyrido[1,2-a]pyrimidin-4-one?
The InChIKey is DPJUFOSNCOSICD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N4O4/c1-3-16-12-18(13-24-21(16)28-2)17-4-5-20-23-14-19(22(27)26(20)15-17)30-11-8-25-6-9-29-10-7-25/h4-5,12-15H,3,6-11H2,1-2H3.
What are the key properties of 7-(5-ethyl-6-methoxy-3-pyridinyl)-3-(2-morpholin-4-ylethoxy)pyrido[1,2-a]pyrimidin-4-one?
7-(5-ethyl-6-methoxy-3-pyridinyl)-3-(2-morpholin-4-ylethoxy)pyrido[1,2-a]pyrimidin-4-one has a molecular weight of 410.47 g/mol, XLogP of 2.04, 7 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(5-ethyl-6-methoxy-3-pyridinyl)-3-(2-morpholin-4-ylethoxy)pyrido[1,2-a]pyrimidin-4-one is sourced from PubChem (CID 129134184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).