(2R)-2-(5-pyridin-3-ylfuran-2-yl)-2,3-dihydro-1H-pyrido[2,3-d]pyrimidin-4-one

C16H12N4O2 — CID 95781853

IUPAC(2R)-2-(5-pyridin-3-ylfuran-2-yl)-2,3-dihydro-1H-pyrido[2,3-d]pyrimidin-4-one
SMILESO=C1N[C@H](c2ccc(-c3cccnc3)o2)Nc2ncccc21
InChIInChI=1S/C16H12N4O2/c21-16-11-4-2-8-18-14(11)19-15(20-16)13-6-5-12(22-13)10-3-1-7-17-9-10/h1-9,15H,(H,18,19)(H,20,21)/t15-/m1/s1
InChIKeyPKUAFYOOKHCJLC-OAHLLOKOSA-N
MW292.30 g/mol
LogP2.59
Rot. Bonds2

About (2R)-2-(5-pyridin-3-ylfuran-2-yl)-2,3-dihydro-1H-pyrido[2,3-d]pyrimidin-4-one

(2R)-2-(5-pyridin-3-ylfuran-2-yl)-2,3-dihydro-1H-pyrido[2,3-d]pyrimidin-4-one (PubChem CID 95781853) has the molecular formula C16H12N4O2 and a molecular weight of 292.30 g/mol. Its IUPAC name is (2R)-2-(5-pyridin-3-ylfuran-2-yl)-2,3-dihydro-1H-pyrido[2,3-d]pyrimidin-4-one.

Molecular Properties

Compound Name(2R)-2-(5-pyridin-3-ylfuran-2-yl)-2,3-dihydro-1H-pyrido[2,3-d]pyrimidin-4-one
PubChem CID95781853
Molecular FormulaC16H12N4O2
Molecular Weight292.30 g/mol
Exact Mass292.10
IUPAC Name(2R)-2-(5-pyridin-3-ylfuran-2-yl)-2,3-dihydro-1H-pyrido[2,3-d]pyrimidin-4-one
SMILESO=C1N[C@H](c2ccc(-c3cccnc3)o2)Nc2ncccc21
InChIInChI=1S/C16H12N4O2/c21-16-11-4-2-8-18-14(11)19-15(20-16)13-6-5-12(22-13)10-3-1-7-17-9-10/h1-9,15H,(H,18,19)(H,20,21)/t15-/m1/s1
InChIKeyPKUAFYOOKHCJLC-OAHLLOKOSA-N
XLogP2.59
TPSA80.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.30
LogP ≤ 52.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-(5-pyridin-3-ylfuran-2-yl)-2,3-dihydro-1H-pyrido[2,3-d]pyrimidin-4-one?
The IUPAC name of (2R)-2-(5-pyridin-3-ylfuran-2-yl)-2,3-dihydro-1H-pyrido[2,3-d]pyrimidin-4-one (CID 95781853) is (2R)-2-(5-pyridin-3-ylfuran-2-yl)-2,3-dihydro-1H-pyrido[2,3-d]pyrimidin-4-one.
What is the SMILES notation for (2R)-2-(5-pyridin-3-ylfuran-2-yl)-2,3-dihydro-1H-pyrido[2,3-d]pyrimidin-4-one?
The canonical SMILES for (2R)-2-(5-pyridin-3-ylfuran-2-yl)-2,3-dihydro-1H-pyrido[2,3-d]pyrimidin-4-one is O=C1N[C@H](c2ccc(-c3cccnc3)o2)Nc2ncccc21.
What is the InChIKey of (2R)-2-(5-pyridin-3-ylfuran-2-yl)-2,3-dihydro-1H-pyrido[2,3-d]pyrimidin-4-one?
The InChIKey is PKUAFYOOKHCJLC-OAHLLOKOSA-N. The full InChI is InChI=1S/C16H12N4O2/c21-16-11-4-2-8-18-14(11)19-15(20-16)13-6-5-12(22-13)10-3-1-7-17-9-10/h1-9,15H,(H,18,19)(H,20,21)/t15-/m1/s1.
What are the key properties of (2R)-2-(5-pyridin-3-ylfuran-2-yl)-2,3-dihydro-1H-pyrido[2,3-d]pyrimidin-4-one?
(2R)-2-(5-pyridin-3-ylfuran-2-yl)-2,3-dihydro-1H-pyrido[2,3-d]pyrimidin-4-one has a molecular weight of 292.30 g/mol, XLogP of 2.59, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(5-pyridin-3-ylfuran-2-yl)-2,3-dihydro-1H-pyrido[2,3-d]pyrimidin-4-one is sourced from PubChem (CID 95781853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).