(4-morpholin-4-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)-(5-propyl-1,2-oxazol-3-yl)methanone

C18H23N5O3 — CID 70778371

IUPAC(4-morpholin-4-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)-(5-propyl-1,2-oxazol-3-yl)methanone
SMILESCCCc1cc(C(=O)N2CCc3c(ncnc3N3CCOCC3)C2)no1
InChIInChI=1S/C18H23N5O3/c1-2-3-13-10-15(21-26-13)18(24)23-5-4-14-16(11-23)19-12-20-17(14)22-6-8-25-9-7-22/h10,12H,2-9,11H2,1H3
InChIKeyCGYRUERMOSITCB-UHFFFAOYSA-N
MW357.41 g/mol
LogP1.45
Rot. Bonds4

About (4-morpholin-4-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)-(5-propyl-1,2-oxazol-3-yl)methanone

(4-morpholin-4-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)-(5-propyl-1,2-oxazol-3-yl)methanone (PubChem CID 70778371) has the molecular formula C18H23N5O3 and a molecular weight of 357.41 g/mol. Its IUPAC name is (4-morpholin-4-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)-(5-propyl-1,2-oxazol-3-yl)methanone.

Molecular Properties

Compound Name(4-morpholin-4-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)-(5-propyl-1,2-oxazol-3-yl)methanone
PubChem CID70778371
Molecular FormulaC18H23N5O3
Molecular Weight357.41 g/mol
Exact Mass357.18
IUPAC Name(4-morpholin-4-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)-(5-propyl-1,2-oxazol-3-yl)methanone
SMILESCCCc1cc(C(=O)N2CCc3c(ncnc3N3CCOCC3)C2)no1
InChIInChI=1S/C18H23N5O3/c1-2-3-13-10-15(21-26-13)18(24)23-5-4-14-16(11-23)19-12-20-17(14)22-6-8-25-9-7-22/h10,12H,2-9,11H2,1H3
InChIKeyCGYRUERMOSITCB-UHFFFAOYSA-N
XLogP1.45
TPSA84.59 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.41
LogP ≤ 51.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze (4-morpholin-4-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)-(5-propyl-1,2-oxazol-3-yl)methanone with MolForge

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Related Compounds

[2-amino-4-(butylamino)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]-(5-methyl-1,2-oxazol-3-yl)methanone
CID 71696038
(5-Methyl-1,2-oxazol-3-yl)-[4-(5-propylpyrimidin-2-yl)piperazin-1-yl]methanone
CID 2812702
2-ethyl-7-(isoxazol-3-ylcarbonyl)-4-morpholin-4-yl-6,7,8,9-tetrahydro-5H-pyrimido[4,5-d]azepine
CID 56884937
(4-pyrimidin-2-ylpiperazin-1-yl)-(5,6,7,8-tetrahydro-4H-cyclohepta[d][1,2]oxazol-3-yl)methanone
CID 71451535
N-methyl-6-[(3-methylisoxazol-5-yl)methyl]-4-(pyrrolidin-1-ylcarbonyl)-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-amine
CID 72906506
[4-(7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-2-yl)piperazin-1-yl]-(3-propan-2-yl-1,2-oxazol-5-yl)methanone
CID 92423779
6-[(5-isopropylisoxazol-3-yl)carbonyl]-N-methyl-4-(pyrrolidin-1-ylcarbonyl)-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-amine
CID 72890578
7-[(3-Isobutylisoxazol-5-yl)carbonyl]-2-methyl-4-pyrrolidin-1-yl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine
CID 56863591
(5-Cyclopropylisoxazol-3-yl)(4-(6-(trifluoromethyl)pyrimidin-4-yl)piperazin-1-yl)methanone
CID 91631510
(5-cyclopropyl-1,2-oxazol-3-yl)-[3-[7-methyl-4-(methylamino)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-2-yl]piperidin-1-yl]methanone
CID 110265758
4-(4-fluoropiperidin-1-yl)-7-(isoxazol-3-ylcarbonyl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-d]azepine
CID 56886209
(5-Cyclopropylisoxazol-3-yl)(3-((5-fluoropyrimidin-2-yl)oxy)piperidin-1-yl)methanone
CID 122160237

Frequently Asked Questions

What is the IUPAC name of (4-morpholin-4-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)-(5-propyl-1,2-oxazol-3-yl)methanone?
The IUPAC name of (4-morpholin-4-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)-(5-propyl-1,2-oxazol-3-yl)methanone (CID 70778371) is (4-morpholin-4-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)-(5-propyl-1,2-oxazol-3-yl)methanone.
What is the SMILES notation for (4-morpholin-4-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)-(5-propyl-1,2-oxazol-3-yl)methanone?
The canonical SMILES for (4-morpholin-4-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)-(5-propyl-1,2-oxazol-3-yl)methanone is CCCc1cc(C(=O)N2CCc3c(ncnc3N3CCOCC3)C2)no1.
What is the InChIKey of (4-morpholin-4-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)-(5-propyl-1,2-oxazol-3-yl)methanone?
The InChIKey is CGYRUERMOSITCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N5O3/c1-2-3-13-10-15(21-26-13)18(24)23-5-4-14-16(11-23)19-12-20-17(14)22-6-8-25-9-7-22/h10,12H,2-9,11H2,1H3.
What are the key properties of (4-morpholin-4-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)-(5-propyl-1,2-oxazol-3-yl)methanone?
(4-morpholin-4-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)-(5-propyl-1,2-oxazol-3-yl)methanone has a molecular weight of 357.41 g/mol, XLogP of 1.45, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (4-morpholin-4-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)-(5-propyl-1,2-oxazol-3-yl)methanone is sourced from PubChem (CID 70778371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).