7-bromo-3-(2-morpholin-4-ylethylamino)pyrido[1,2-a]pyrimidin-4-one

C14H17BrN4O2 — CID 118613302

IUPAC7-bromo-3-(2-morpholin-4-ylethylamino)pyrido[1,2-a]pyrimidin-4-one
SMILESO=c1c(NCCN2CCOCC2)cnc2ccc(Br)cn12
InChIInChI=1S/C14H17BrN4O2/c15-11-1-2-13-17-9-12(14(20)19(13)10-11)16-3-4-18-5-7-21-8-6-18/h1-2,9-10,16H,3-8H2
InChIKeyOAEPHRZPJGJKGA-UHFFFAOYSA-N
MW353.22 g/mol
LogP1.20
Rot. Bonds4

About 7-bromo-3-(2-morpholin-4-ylethylamino)pyrido[1,2-a]pyrimidin-4-one

7-bromo-3-(2-morpholin-4-ylethylamino)pyrido[1,2-a]pyrimidin-4-one (PubChem CID 118613302) has the molecular formula C14H17BrN4O2 and a molecular weight of 353.22 g/mol. Its IUPAC name is 7-bromo-3-(2-morpholin-4-ylethylamino)pyrido[1,2-a]pyrimidin-4-one.

Molecular Properties

Compound Name7-bromo-3-(2-morpholin-4-ylethylamino)pyrido[1,2-a]pyrimidin-4-one
PubChem CID118613302
Molecular FormulaC14H17BrN4O2
Molecular Weight353.22 g/mol
Exact Mass352.05
IUPAC Name7-bromo-3-(2-morpholin-4-ylethylamino)pyrido[1,2-a]pyrimidin-4-one
SMILESO=c1c(NCCN2CCOCC2)cnc2ccc(Br)cn12
InChIInChI=1S/C14H17BrN4O2/c15-11-1-2-13-17-9-12(14(20)19(13)10-11)16-3-4-18-5-7-21-8-6-18/h1-2,9-10,16H,3-8H2
InChIKeyOAEPHRZPJGJKGA-UHFFFAOYSA-N
XLogP1.20
TPSA58.87 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.22
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

6-bromo-2-(2-methyl-1H-imidazol-5-yl)-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine
CID 155524846
3-bromo-N-(2-morpholin-4-ylethyl)quinolin-8-amine
CID 116784312
4-bromo-2,3-dichloro-N-(2-morpholin-4-ylethyl)aniline
CID 107789141
6-bromo-N-(2-morpholin-4-ylethyl)quinazolin-4-amine
CID 728957
4-bromo-5-(2-morpholin-4-ylethylamino)-2-prop-2-enylpyridazin-3-one
CID 114432525
3-amino-7-bromopyrido[1,2-a]pyrimidin-4-one
CID 83898748
N-(2-morpholin-4-ylethyl)-2-[(5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)amino]acetamide
CID 44782687
5-[3-(4-methylphenyl)imidazo[1,2-a]pyrazin-6-yl]-N-(2-morpholin-4-ylethyl)pyridin-2-amine
CID 140905207
9-bromo-N-(2-morpholin-4-ylethyl)-5,12-dioxoindolizino[2,3-g]quinoline-6-carboxamide
CID 54770717
2-bromo-3-fluoro-4-(2-morpholin-4-ylethylamino)benzoic acid
CID 107539944
4-N-(4-bromo-2-methylphenyl)-6-N-(2-morpholin-4-ylethyl)pyrimidine-4,6-diamine
CID 112857691
4-bromo-3-fluoro-N-(2-morpholin-4-ylethyl)aniline
CID 65437336

Frequently Asked Questions

What is the IUPAC name of 7-bromo-3-(2-morpholin-4-ylethylamino)pyrido[1,2-a]pyrimidin-4-one?
The IUPAC name of 7-bromo-3-(2-morpholin-4-ylethylamino)pyrido[1,2-a]pyrimidin-4-one (CID 118613302) is 7-bromo-3-(2-morpholin-4-ylethylamino)pyrido[1,2-a]pyrimidin-4-one.
What is the SMILES notation for 7-bromo-3-(2-morpholin-4-ylethylamino)pyrido[1,2-a]pyrimidin-4-one?
The canonical SMILES for 7-bromo-3-(2-morpholin-4-ylethylamino)pyrido[1,2-a]pyrimidin-4-one is O=c1c(NCCN2CCOCC2)cnc2ccc(Br)cn12.
What is the InChIKey of 7-bromo-3-(2-morpholin-4-ylethylamino)pyrido[1,2-a]pyrimidin-4-one?
The InChIKey is OAEPHRZPJGJKGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17BrN4O2/c15-11-1-2-13-17-9-12(14(20)19(13)10-11)16-3-4-18-5-7-21-8-6-18/h1-2,9-10,16H,3-8H2.
What are the key properties of 7-bromo-3-(2-morpholin-4-ylethylamino)pyrido[1,2-a]pyrimidin-4-one?
7-bromo-3-(2-morpholin-4-ylethylamino)pyrido[1,2-a]pyrimidin-4-one has a molecular weight of 353.22 g/mol, XLogP of 1.20, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-3-(2-morpholin-4-ylethylamino)pyrido[1,2-a]pyrimidin-4-one is sourced from PubChem (CID 118613302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).