2-(4-chlorophenyl)-5-cyclopropyl-3-phenyl-1,6-naphthyridine

C23H17ClN2 — CID 67002197

IUPAC2-(4-chlorophenyl)-5-cyclopropyl-3-phenyl-1,6-naphthyridine
SMILESClc1ccc(-c2nc3ccnc(C4CC4)c3cc2-c2ccccc2)cc1
InChIInChI=1S/C23H17ClN2/c24-18-10-8-17(9-11-18)23-19(15-4-2-1-3-5-15)14-20-21(26-23)12-13-25-22(20)16-6-7-16/h1-5,8-14,16H,6-7H2
InChIKeyYILGFOITXAGBHB-UHFFFAOYSA-N
MW356.86 g/mol
LogP6.49
Rot. Bonds3

About 2-(4-chlorophenyl)-5-cyclopropyl-3-phenyl-1,6-naphthyridine

2-(4-chlorophenyl)-5-cyclopropyl-3-phenyl-1,6-naphthyridine (PubChem CID 67002197) has the molecular formula C23H17ClN2 and a molecular weight of 356.86 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-5-cyclopropyl-3-phenyl-1,6-naphthyridine.

Molecular Properties

Compound Name2-(4-chlorophenyl)-5-cyclopropyl-3-phenyl-1,6-naphthyridine
PubChem CID67002197
Molecular FormulaC23H17ClN2
Molecular Weight356.86 g/mol
Exact Mass356.11
IUPAC Name2-(4-chlorophenyl)-5-cyclopropyl-3-phenyl-1,6-naphthyridine
SMILESClc1ccc(-c2nc3ccnc(C4CC4)c3cc2-c2ccccc2)cc1
InChIInChI=1S/C23H17ClN2/c24-18-10-8-17(9-11-18)23-19(15-4-2-1-3-5-15)14-20-21(26-23)12-13-25-22(20)16-6-7-16/h1-5,8-14,16H,6-7H2
InChIKeyYILGFOITXAGBHB-UHFFFAOYSA-N
XLogP6.49
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500356.86
LogP ≤ 56.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-chloro-2-(4-cyclopropylphenyl)-3-phenyl-1,6-naphthyridine
CID 87574586
5-chloro-2-(4-chlorophenyl)-3-phenyl-1,6-naphthyridine;methanamine
CID 87574008
2-(4-cyclobutylphenyl)-5-methyl-3-phenyl-1,6-naphthyridine
CID 68784299
[1-[4-(5-chloro-3-phenyl-1,6-naphthyridin-2-yl)phenyl]cyclopropyl]azanium chloride
CID 86659516
1-[4-(5-chloro-3-phenyl-1,6-naphthyridin-2-yl)phenyl]cyclopropan-1-amine
CID 58524603
5-chloro-2-(4-cyclobutylphenyl)-3-(4-fluorophenyl)-1,6-naphthyridine
CID 87585565
(1R)-1-[4-(5-chloro-3-phenyl-1,6-naphthyridin-2-yl)phenyl]ethanamine
CID 58524476
3,7-bis(4-chlorophenyl)-2,8-diphenylpyrazino[2,3-g]quinoxaline
CID 21026465
[4-[5-[2-[4-(azaniumylmethyl)phenyl]-3-phenyl-1,6-naphthyridin-5-yl]-3-phenyl-1,6-naphthyridin-2-yl]phenyl]methylazanium
CID 58524189
2-[4-(1-benzylcyclopropyl)phenyl]-5-chloro-3-phenyl-1,6-naphthyridine
CID 87561536
[4-(3,5-diphenyl-1,6-naphthyridin-2-yl)phenyl]methanamine;dihydrochloride
CID 173038029
[2-(4-methylphenyl)-3-phenyl-1,6-naphthyridin-5-yl]methanamine
CID 173108160

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-5-cyclopropyl-3-phenyl-1,6-naphthyridine?
The IUPAC name of 2-(4-chlorophenyl)-5-cyclopropyl-3-phenyl-1,6-naphthyridine (CID 67002197) is 2-(4-chlorophenyl)-5-cyclopropyl-3-phenyl-1,6-naphthyridine.
What is the SMILES notation for 2-(4-chlorophenyl)-5-cyclopropyl-3-phenyl-1,6-naphthyridine?
The canonical SMILES for 2-(4-chlorophenyl)-5-cyclopropyl-3-phenyl-1,6-naphthyridine is Clc1ccc(-c2nc3ccnc(C4CC4)c3cc2-c2ccccc2)cc1.
What is the InChIKey of 2-(4-chlorophenyl)-5-cyclopropyl-3-phenyl-1,6-naphthyridine?
The InChIKey is YILGFOITXAGBHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17ClN2/c24-18-10-8-17(9-11-18)23-19(15-4-2-1-3-5-15)14-20-21(26-23)12-13-25-22(20)16-6-7-16/h1-5,8-14,16H,6-7H2.
What are the key properties of 2-(4-chlorophenyl)-5-cyclopropyl-3-phenyl-1,6-naphthyridine?
2-(4-chlorophenyl)-5-cyclopropyl-3-phenyl-1,6-naphthyridine has a molecular weight of 356.86 g/mol, XLogP of 6.49, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-5-cyclopropyl-3-phenyl-1,6-naphthyridine is sourced from PubChem (CID 67002197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).