3-(4-methoxyphenyl)-1-phenylpyrazolo[4,3-c][1,6]naphthyridine

C22H16N4O — CID 97032775

IUPAC3-(4-methoxyphenyl)-1-phenylpyrazolo[4,3-c][1,6]naphthyridine
SMILESCOc1ccc(-c2nn(-c3ccccc3)c3c2cnc2ccncc23)cc1
InChIInChI=1S/C22H16N4O/c1-27-17-9-7-15(8-10-17)21-19-14-24-20-11-12-23-13-18(20)22(19)26(25-21)16-5-3-2-4-6-16/h2-14H,1H3
InChIKeyARQWEKYJPDAEMZ-UHFFFAOYSA-N
MW352.40 g/mol
LogP4.64
Rot. Bonds3

About 3-(4-methoxyphenyl)-1-phenylpyrazolo[4,3-c][1,6]naphthyridine

3-(4-methoxyphenyl)-1-phenylpyrazolo[4,3-c][1,6]naphthyridine (PubChem CID 97032775) has the molecular formula C22H16N4O and a molecular weight of 352.40 g/mol. Its IUPAC name is 3-(4-methoxyphenyl)-1-phenylpyrazolo[4,3-c][1,6]naphthyridine.

Molecular Properties

Compound Name3-(4-methoxyphenyl)-1-phenylpyrazolo[4,3-c][1,6]naphthyridine
PubChem CID97032775
Molecular FormulaC22H16N4O
Molecular Weight352.40 g/mol
Exact Mass352.13
IUPAC Name3-(4-methoxyphenyl)-1-phenylpyrazolo[4,3-c][1,6]naphthyridine
SMILESCOc1ccc(-c2nn(-c3ccccc3)c3c2cnc2ccncc23)cc1
InChIInChI=1S/C22H16N4O/c1-27-17-9-7-15(8-10-17)21-19-14-24-20-11-12-23-13-18(20)22(19)26(25-21)16-5-3-2-4-6-16/h2-14H,1H3
InChIKeyARQWEKYJPDAEMZ-UHFFFAOYSA-N
XLogP4.64
TPSA52.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.40
LogP ≤ 54.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

8-methoxy-3-(4-methylphenyl)-1-phenylpyrazolo[4,3-c]quinoline
CID 20852567
3-(4-bromo-3-chlorophenyl)-8-methoxy-1-phenylpyrazolo[4,3-c]quinoline
CID 171775671
8-fluoro-1-(4-methoxyphenyl)-3-(4-methylphenyl)pyrazolo[4,3-c]quinoline
CID 20953354
6,8-difluoro-1-(4-methoxyphenyl)-3-phenylpyrazolo[4,3-c]quinoline
CID 20852710
1-(3-chloro-4-methylphenyl)-8-methoxy-3-phenylpyrazolo[4,3-c]quinoline
CID 20852727
1-(4-fluorophenyl)-8-methoxy-3-(4-methylphenyl)pyrazolo[4,3-c]quinoline
CID 20852568
8-methoxy-3-(4-methylphenyl)-1-(3-nitrophenyl)pyrazolo[4,3-c]quinoline
CID 46251420
14-(4-fluorophenyl)-12-(4-methoxyphenyl)-4,7-dioxa-12,13,17-triazatetracyclo[8.7.0.03,8.011,15]heptadeca-1,3(8),9,11(15),13,16-hexaene
CID 20852714
8-(4-methoxyphenyl)-6-phenylpyrido[2,3-d]pyridazin-5-one
CID 19700943
8-bromo-1,3-diphenylpyrazolo[4,3-c]quinoline
CID 20852418
8-methoxy-3-(3-methoxyphenyl)-1-(3-nitrophenyl)pyrazolo[4,3-c]quinoline
CID 46251447
1-(4-chlorophenyl)-3-(4-ethylphenyl)-8-methoxypyrazolo[4,3-c]quinoline
CID 20852791

Frequently Asked Questions

What is the IUPAC name of 3-(4-methoxyphenyl)-1-phenylpyrazolo[4,3-c][1,6]naphthyridine?
The IUPAC name of 3-(4-methoxyphenyl)-1-phenylpyrazolo[4,3-c][1,6]naphthyridine (CID 97032775) is 3-(4-methoxyphenyl)-1-phenylpyrazolo[4,3-c][1,6]naphthyridine.
What is the SMILES notation for 3-(4-methoxyphenyl)-1-phenylpyrazolo[4,3-c][1,6]naphthyridine?
The canonical SMILES for 3-(4-methoxyphenyl)-1-phenylpyrazolo[4,3-c][1,6]naphthyridine is COc1ccc(-c2nn(-c3ccccc3)c3c2cnc2ccncc23)cc1.
What is the InChIKey of 3-(4-methoxyphenyl)-1-phenylpyrazolo[4,3-c][1,6]naphthyridine?
The InChIKey is ARQWEKYJPDAEMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16N4O/c1-27-17-9-7-15(8-10-17)21-19-14-24-20-11-12-23-13-18(20)22(19)26(25-21)16-5-3-2-4-6-16/h2-14H,1H3.
What are the key properties of 3-(4-methoxyphenyl)-1-phenylpyrazolo[4,3-c][1,6]naphthyridine?
3-(4-methoxyphenyl)-1-phenylpyrazolo[4,3-c][1,6]naphthyridine has a molecular weight of 352.40 g/mol, XLogP of 4.64, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methoxyphenyl)-1-phenylpyrazolo[4,3-c][1,6]naphthyridine is sourced from PubChem (CID 97032775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).