6-pyrimidin-5-yl-2H-2,7-naphthyridin-1-one

C12H8N4O — CID 142785387

IUPAC6-pyrimidin-5-yl-2H-2,7-naphthyridin-1-one
SMILESO=c1[nH]ccc2cc(-c3cncnc3)ncc12
InChIInChI=1S/C12H8N4O/c17-12-10-6-16-11(3-8(10)1-2-15-12)9-4-13-7-14-5-9/h1-7H,(H,15,17)
InChIKeyUZEAXUIPLOSLEB-UHFFFAOYSA-N
MW224.22 g/mol
LogP1.38
Rot. Bonds1

About 6-pyrimidin-5-yl-2H-2,7-naphthyridin-1-one

6-pyrimidin-5-yl-2H-2,7-naphthyridin-1-one (PubChem CID 142785387) has the molecular formula C12H8N4O and a molecular weight of 224.22 g/mol. Its IUPAC name is 6-pyrimidin-5-yl-2H-2,7-naphthyridin-1-one.

Molecular Properties

Compound Name6-pyrimidin-5-yl-2H-2,7-naphthyridin-1-one
PubChem CID142785387
Molecular FormulaC12H8N4O
Molecular Weight224.22 g/mol
Exact Mass224.07
IUPAC Name6-pyrimidin-5-yl-2H-2,7-naphthyridin-1-one
SMILESO=c1[nH]ccc2cc(-c3cncnc3)ncc12
InChIInChI=1S/C12H8N4O/c17-12-10-6-16-11(3-8(10)1-2-15-12)9-4-13-7-14-5-9/h1-7H,(H,15,17)
InChIKeyUZEAXUIPLOSLEB-UHFFFAOYSA-N
XLogP1.38
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.22
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

8-amino-6-pyrimidin-5-yl-2H-2,7-naphthyridin-1-one
CID 58094010
3-pyrimidin-5-yl-1H-pyrazin-2-one
CID 106516220
N-methyl-3-[(8-oxo-3-pyrimidin-5-yl-7H-2,7-naphthyridin-1-yl)amino]benzenesulfonamide
CID 58094203
8-[4-(4-hydroxypiperidin-1-yl)anilino]-6-pyrimidin-5-yl-2H-2,7-naphthyridin-1-one
CID 58094084
[5-(1H-pyrrolo[2,3-c]pyridin-5-yl)-3-pyridinyl]carbamic acid
CID 135263765
ethane;6-methyl-2H-isoquinolin-1-one
CID 142940504
8-[4-(2-pyridin-3-yl-1,3-thiazol-4-yl)anilino]-6-pyrimidin-5-yl-2H-2,7-naphthyridin-1-one
CID 58093747
7-(5-methyl-1H-pyrazol-3-yl)-2H-isoquinolin-1-one
CID 122556149
2,2-difluoro-6H-[1,3]dioxolo[4,5-g]isoquinolin-5-one
CID 22250275
8-[4-(2-morpholin-4-ylethyl)anilino]-6-pyrimidin-5-yl-2H-2,7-naphthyridin-1-one
CID 58094280
6,7-bis(hydroxymethyl)-2H-isoquinolin-1-one
CID 71215768
6-chloro-2H-isoquinolin-1-one;1,6-dichloroisoquinoline
CID 161054637

Frequently Asked Questions

What is the IUPAC name of 6-pyrimidin-5-yl-2H-2,7-naphthyridin-1-one?
The IUPAC name of 6-pyrimidin-5-yl-2H-2,7-naphthyridin-1-one (CID 142785387) is 6-pyrimidin-5-yl-2H-2,7-naphthyridin-1-one.
What is the SMILES notation for 6-pyrimidin-5-yl-2H-2,7-naphthyridin-1-one?
The canonical SMILES for 6-pyrimidin-5-yl-2H-2,7-naphthyridin-1-one is O=c1[nH]ccc2cc(-c3cncnc3)ncc12.
What is the InChIKey of 6-pyrimidin-5-yl-2H-2,7-naphthyridin-1-one?
The InChIKey is UZEAXUIPLOSLEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8N4O/c17-12-10-6-16-11(3-8(10)1-2-15-12)9-4-13-7-14-5-9/h1-7H,(H,15,17).
What are the key properties of 6-pyrimidin-5-yl-2H-2,7-naphthyridin-1-one?
6-pyrimidin-5-yl-2H-2,7-naphthyridin-1-one has a molecular weight of 224.22 g/mol, XLogP of 1.38, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-pyrimidin-5-yl-2H-2,7-naphthyridin-1-one is sourced from PubChem (CID 142785387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).