2-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1,6-naphthyridine

C22H17N3 — CID 90095866

IUPAC2-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1,6-naphthyridine
SMILESc1cc(-c2ncccc2-c2ccc3cnccc3n2)cc(C2CC2)c1
InChIInChI=1S/C22H17N3/c1-3-16(15-6-7-15)13-17(4-1)22-19(5-2-11-24-22)21-9-8-18-14-23-12-10-20(18)25-21/h1-5,8-15H,6-7H2
InChIKeyUNAPBIXNPYNURR-UHFFFAOYSA-N
MW323.40 g/mol
LogP5.24
Rot. Bonds3

About 2-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1,6-naphthyridine

2-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1,6-naphthyridine (PubChem CID 90095866) has the molecular formula C22H17N3 and a molecular weight of 323.40 g/mol. Its IUPAC name is 2-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1,6-naphthyridine.

Molecular Properties

Compound Name2-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1,6-naphthyridine
PubChem CID90095866
Molecular FormulaC22H17N3
Molecular Weight323.40 g/mol
Exact Mass323.14
IUPAC Name2-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1,6-naphthyridine
SMILESc1cc(-c2ncccc2-c2ccc3cnccc3n2)cc(C2CC2)c1
InChIInChI=1S/C22H17N3/c1-3-16(15-6-7-15)13-17(4-1)22-19(5-2-11-24-22)21-9-8-18-14-23-12-10-20(18)25-21/h1-5,8-15H,6-7H2
InChIKeyUNAPBIXNPYNURR-UHFFFAOYSA-N
XLogP5.24
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500323.40
LogP ≤ 55.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1H-pyrazolo[3,4-b]pyridine
CID 90095575
N'-[5-[2-(3-cyclopropylphenyl)-3-pyridinyl]pyrimidin-2-yl]methanimidamide
CID 144602381
6-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1-methylbenzimidazole
CID 90095898
3-(3-cyclobutylphenyl)pyridin-2-amine
CID 114605099
4-[6-[2-(3-cyclopropylphenyl)-3-pyridinyl]quinazolin-4-yl]morpholine
CID 90095353
3-(3-cyclobutylphenyl)-1H-pyrazine-2-thione
CID 106522498
9-cyclopropylpyrido[3,2-b]phenazine-5,12-dione
CID 155690252
3-[4-[6-(3-cyclohexylphenyl)dibenzothiophen-4-yl]phenyl]pyridine
CID 171761271
2,3-dipyridin-3-ylpyridine;hydrobromide
CID 175062851
2,3-dipyridin-3-ylpyridine;methane
CID 174971096
2,3-dipyridin-3-ylpyridine;ruthenium(3+);trichloride
CID 175008055
(3-cyclopropylphenyl)-isoquinolin-5-ylmethanol
CID 79972222

Frequently Asked Questions

What is the IUPAC name of 2-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1,6-naphthyridine?
The IUPAC name of 2-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1,6-naphthyridine (CID 90095866) is 2-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1,6-naphthyridine.
What is the SMILES notation for 2-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1,6-naphthyridine?
The canonical SMILES for 2-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1,6-naphthyridine is c1cc(-c2ncccc2-c2ccc3cnccc3n2)cc(C2CC2)c1.
What is the InChIKey of 2-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1,6-naphthyridine?
The InChIKey is UNAPBIXNPYNURR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17N3/c1-3-16(15-6-7-15)13-17(4-1)22-19(5-2-11-24-22)21-9-8-18-14-23-12-10-20(18)25-21/h1-5,8-15H,6-7H2.
What are the key properties of 2-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1,6-naphthyridine?
2-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1,6-naphthyridine has a molecular weight of 323.40 g/mol, XLogP of 5.24, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1,6-naphthyridine is sourced from PubChem (CID 90095866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).