8-chloro-2-(3-iodophenyl)-1,7-naphthyridine

C14H8ClIN2 — CID 155340444

IUPAC8-chloro-2-(3-iodophenyl)-1,7-naphthyridine
SMILESClc1nccc2ccc(-c3cccc(I)c3)nc12
InChIInChI=1S/C14H8ClIN2/c15-14-13-9(6-7-17-14)4-5-12(18-13)10-2-1-3-11(16)8-10/h1-8H
InChIKeyCJIDUAUYTVBGHA-UHFFFAOYSA-N
MW366.59 g/mol
LogP4.55
Rot. Bonds1

About 8-chloro-2-(3-iodophenyl)-1,7-naphthyridine

8-chloro-2-(3-iodophenyl)-1,7-naphthyridine (PubChem CID 155340444) has the molecular formula C14H8ClIN2 and a molecular weight of 366.59 g/mol. Its IUPAC name is 8-chloro-2-(3-iodophenyl)-1,7-naphthyridine.

Molecular Properties

Compound Name8-chloro-2-(3-iodophenyl)-1,7-naphthyridine
PubChem CID155340444
Molecular FormulaC14H8ClIN2
Molecular Weight366.59 g/mol
Exact Mass365.94
IUPAC Name8-chloro-2-(3-iodophenyl)-1,7-naphthyridine
SMILESClc1nccc2ccc(-c3cccc(I)c3)nc12
InChIInChI=1S/C14H8ClIN2/c15-14-13-9(6-7-17-14)4-5-12(18-13)10-2-1-3-11(16)8-10/h1-8H
InChIKeyCJIDUAUYTVBGHA-UHFFFAOYSA-N
XLogP4.55
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.59
LogP ≤ 54.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

4-chloro-6-(3-iodophenyl)pyrido[3,2-d]pyrimidine
CID 155728996
32,56,61-triazapentadecacyclo[53.2.2.27,57.28,11.212,15.221,24.225,28.239,42.243,46.247,50.251,54.116,20.129,33.134,38.04,60]octaconta-1(57),2,4(60),5,7(61),8(80),9,11(79),12(78),13,15(77),16,18,20(76),21(75),22,24(74),25(73),26,28(72),29(71),30,32,34,36,38(70),39,41,43,45,47,49,51,53,55,58,62,64,66,68-tetracontaene
CID 140920223
22-(3-pyridin-2-ylphenyl)-52,55-diazatridecacyclo[41.8.4.22,5.211,14.230,33.239,42.16,10.115,19.120,24.125,29.134,38.046,54.049,53]octahexaconta-1(52),2(68),3,5(67),6,8,10(66),11(65),12,14(64),15(63),16,18,20(62),21,23,25,27,29(61),30,32,34(58),35,37,39,41,43(55),44,46(54),47,49(53),50,56,59-tetratriacontaene
CID 140920150
6-(3-iodophenyl)pyrido[3,2-d]pyrimidine-4-carbonitrile
CID 155341345
6-(3-iodophenyl)pyridin-2-amine
CID 22752768
2-phenyl-9-[3-[4-[3-phenyl-5-(4-phenylphenyl)phenyl]phenyl]phenyl]-1,10-phenanthroline
CID 138725055
2-phenyl-9-[3-[3-phenyl-5-(4-phenylphenyl)phenyl]phenyl]-1,10-phenanthroline
CID 138725062
4-[8-chloro-2-(3-iodophenyl)pyrido[3,4-d]pyrimidin-4-yl]morpholine
CID 155340979
2-(4-pyridin-2-ylphenyl)-9-(3-triphenylen-2-ylphenyl)-1,10-phenanthroline
CID 134167600
2-phenyl-9-[4-[3-[4-(9-phenyl-1,10-phenanthrolin-2-yl)phenyl]phenyl]phenyl]-1,10-phenanthroline
CID 59010455
8-[3-(3-iodophenyl)phenyl]quinoline
CID 134445646
2-(3-phenylphenyl)-1,10-phenanthroline
CID 118188250

Frequently Asked Questions

What is the IUPAC name of 8-chloro-2-(3-iodophenyl)-1,7-naphthyridine?
The IUPAC name of 8-chloro-2-(3-iodophenyl)-1,7-naphthyridine (CID 155340444) is 8-chloro-2-(3-iodophenyl)-1,7-naphthyridine.
What is the SMILES notation for 8-chloro-2-(3-iodophenyl)-1,7-naphthyridine?
The canonical SMILES for 8-chloro-2-(3-iodophenyl)-1,7-naphthyridine is Clc1nccc2ccc(-c3cccc(I)c3)nc12.
What is the InChIKey of 8-chloro-2-(3-iodophenyl)-1,7-naphthyridine?
The InChIKey is CJIDUAUYTVBGHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8ClIN2/c15-14-13-9(6-7-17-14)4-5-12(18-13)10-2-1-3-11(16)8-10/h1-8H.
What are the key properties of 8-chloro-2-(3-iodophenyl)-1,7-naphthyridine?
8-chloro-2-(3-iodophenyl)-1,7-naphthyridine has a molecular weight of 366.59 g/mol, XLogP of 4.55, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-chloro-2-(3-iodophenyl)-1,7-naphthyridine is sourced from PubChem (CID 155340444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).