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

C14H14N4O2 — CID 72719434

IUPAC(5-cyclopropyl-1,2-oxazol-3-yl)-(7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)methanone
SMILESO=C(c1cc(C2CC2)on1)N1CCc2ncncc2C1
InChIInChI=1S/C14H14N4O2/c19-14(12-5-13(20-17-12)9-1-2-9)18-4-3-11-10(7-18)6-15-8-16-11/h5-6,8-9H,1-4,7H2
InChIKeyQPFWPHTVUOOZOR-UHFFFAOYSA-N
MW270.29 g/mol
LogP1.54
Rot. Bonds2

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

(5-cyclopropyl-1,2-oxazol-3-yl)-(7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)methanone (PubChem CID 72719434) has the molecular formula C14H14N4O2 and a molecular weight of 270.29 g/mol. Its IUPAC name is (5-cyclopropyl-1,2-oxazol-3-yl)-(7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)methanone.

Molecular Properties

Compound Name(5-cyclopropyl-1,2-oxazol-3-yl)-(7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)methanone
PubChem CID72719434
Molecular FormulaC14H14N4O2
Molecular Weight270.29 g/mol
Exact Mass270.11
IUPAC Name(5-cyclopropyl-1,2-oxazol-3-yl)-(7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)methanone
SMILESO=C(c1cc(C2CC2)on1)N1CCc2ncncc2C1
InChIInChI=1S/C14H14N4O2/c19-14(12-5-13(20-17-12)9-1-2-9)18-4-3-11-10(7-18)6-15-8-16-11/h5-6,8-9H,1-4,7H2
InChIKeyQPFWPHTVUOOZOR-UHFFFAOYSA-N
XLogP1.54
TPSA72.12 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.29
LogP ≤ 51.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (5-cyclopropyl-1,2-oxazol-3-yl)-(7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)methanone?
The IUPAC name of (5-cyclopropyl-1,2-oxazol-3-yl)-(7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)methanone (CID 72719434) is (5-cyclopropyl-1,2-oxazol-3-yl)-(7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)methanone.
What is the SMILES notation for (5-cyclopropyl-1,2-oxazol-3-yl)-(7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)methanone?
The canonical SMILES for (5-cyclopropyl-1,2-oxazol-3-yl)-(7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)methanone is O=C(c1cc(C2CC2)on1)N1CCc2ncncc2C1.
What is the InChIKey of (5-cyclopropyl-1,2-oxazol-3-yl)-(7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)methanone?
The InChIKey is QPFWPHTVUOOZOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4O2/c19-14(12-5-13(20-17-12)9-1-2-9)18-4-3-11-10(7-18)6-15-8-16-11/h5-6,8-9H,1-4,7H2.
What are the key properties of (5-cyclopropyl-1,2-oxazol-3-yl)-(7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)methanone?
(5-cyclopropyl-1,2-oxazol-3-yl)-(7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)methanone has a molecular weight of 270.29 g/mol, XLogP of 1.54, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5-cyclopropyl-1,2-oxazol-3-yl)-(7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)methanone is sourced from PubChem (CID 72719434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).