6-(3-pyrazol-1-ylpropyl)-1,6-naphthyridin-5-one

C14H14N4O — CID 72935300

IUPAC6-(3-pyrazol-1-ylpropyl)-1,6-naphthyridin-5-one
SMILESO=c1c2cccnc2ccn1CCCn1cccn1
InChIInChI=1S/C14H14N4O/c19-14-12-4-1-6-15-13(12)5-11-17(14)8-3-10-18-9-2-7-16-18/h1-2,4-7,9,11H,3,8,10H2
InChIKeyDREMCLNNIIFYSS-UHFFFAOYSA-N
MW254.29 g/mol
LogP1.68
Rot. Bonds4

About 6-(3-pyrazol-1-ylpropyl)-1,6-naphthyridin-5-one

6-(3-pyrazol-1-ylpropyl)-1,6-naphthyridin-5-one (PubChem CID 72935300) has the molecular formula C14H14N4O and a molecular weight of 254.29 g/mol. Its IUPAC name is 6-(3-pyrazol-1-ylpropyl)-1,6-naphthyridin-5-one.

Molecular Properties

Compound Name6-(3-pyrazol-1-ylpropyl)-1,6-naphthyridin-5-one
PubChem CID72935300
Molecular FormulaC14H14N4O
Molecular Weight254.29 g/mol
Exact Mass254.12
IUPAC Name6-(3-pyrazol-1-ylpropyl)-1,6-naphthyridin-5-one
SMILESO=c1c2cccnc2ccn1CCCn1cccn1
InChIInChI=1S/C14H14N4O/c19-14-12-4-1-6-15-13(12)5-11-17(14)8-3-10-18-9-2-7-16-18/h1-2,4-7,9,11H,3,8,10H2
InChIKeyDREMCLNNIIFYSS-UHFFFAOYSA-N
XLogP1.68
TPSA52.71 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 51.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

6-[(2-ethyl-1,3-thiazol-4-yl)methyl]-1,6-naphthyridin-5-one
CID 72920970
6-[2-[4-(1,2-benzoxazol-3-yl)piperazin-1-yl]ethyl]-1,6-naphthyridin-5-one
CID 146344656
1-(3-pyrazol-1-ylpropyl)-6,7-dihydro-5H-indol-4-one
CID 113413211
2-(6-bromo-4-oxoquinazolin-3-yl)-N-(3-pyrazol-1-ylpropyl)acetamide
CID 55719002
5-methyl-3-(3-pyrazol-1-ylpropyl)thieno[2,3-d]pyrimidin-4-one
CID 39834583
N-(cyclohexylmethyl)-2-(5-oxo-1,6-naphthyridin-6-yl)acetamide
CID 72861872
3-(4-aminobutyl)quinazolin-4-one
CID 28823941
2-(4-pyrazol-1-ylbutyl)isoindole-1,3-dione
CID 14662143
3-propylquinazolin-4-one
CID 529124
6-[[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-1,6-naphthyridin-5-one
CID 72847701
3-(5-aminopentyl)quinazolin-4-one
CID 54965918
2-(10-pyrazol-1-yldecyl)isoindole-1,3-dione
CID 14662149

Frequently Asked Questions

What is the IUPAC name of 6-(3-pyrazol-1-ylpropyl)-1,6-naphthyridin-5-one?
The IUPAC name of 6-(3-pyrazol-1-ylpropyl)-1,6-naphthyridin-5-one (CID 72935300) is 6-(3-pyrazol-1-ylpropyl)-1,6-naphthyridin-5-one.
What is the SMILES notation for 6-(3-pyrazol-1-ylpropyl)-1,6-naphthyridin-5-one?
The canonical SMILES for 6-(3-pyrazol-1-ylpropyl)-1,6-naphthyridin-5-one is O=c1c2cccnc2ccn1CCCn1cccn1.
What is the InChIKey of 6-(3-pyrazol-1-ylpropyl)-1,6-naphthyridin-5-one?
The InChIKey is DREMCLNNIIFYSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4O/c19-14-12-4-1-6-15-13(12)5-11-17(14)8-3-10-18-9-2-7-16-18/h1-2,4-7,9,11H,3,8,10H2.
What are the key properties of 6-(3-pyrazol-1-ylpropyl)-1,6-naphthyridin-5-one?
6-(3-pyrazol-1-ylpropyl)-1,6-naphthyridin-5-one has a molecular weight of 254.29 g/mol, XLogP of 1.68, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-pyrazol-1-ylpropyl)-1,6-naphthyridin-5-one is sourced from PubChem (CID 72935300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).