2-fluoro-7-phenyl-6H-chromeno[4,3-b][1,8]naphthyridine

C21H13FN2O — CID 164619317

IUPAC2-fluoro-7-phenyl-6H-chromeno[4,3-b][1,8]naphthyridine
SMILESFc1ccc2c(c1)-c1nc3ncccc3c(-c3ccccc3)c1CO2
InChIInChI=1S/C21H13FN2O/c22-14-8-9-18-16(11-14)20-17(12-25-18)19(13-5-2-1-3-6-13)15-7-4-10-23-21(15)24-20/h1-11H,12H2
InChIKeyZKRYJIKRNQPCIG-UHFFFAOYSA-N
MW328.35 g/mol
LogP5.00
Rot. Bonds1

About 2-fluoro-7-phenyl-6H-chromeno[4,3-b][1,8]naphthyridine

2-fluoro-7-phenyl-6H-chromeno[4,3-b][1,8]naphthyridine (PubChem CID 164619317) has the molecular formula C21H13FN2O and a molecular weight of 328.35 g/mol. Its IUPAC name is 2-fluoro-7-phenyl-6H-chromeno[4,3-b][1,8]naphthyridine.

Molecular Properties

Compound Name2-fluoro-7-phenyl-6H-chromeno[4,3-b][1,8]naphthyridine
PubChem CID164619317
Molecular FormulaC21H13FN2O
Molecular Weight328.35 g/mol
Exact Mass328.10
IUPAC Name2-fluoro-7-phenyl-6H-chromeno[4,3-b][1,8]naphthyridine
SMILESFc1ccc2c(c1)-c1nc3ncccc3c(-c3ccccc3)c1CO2
InChIInChI=1S/C21H13FN2O/c22-14-8-9-18-16(11-14)20-17(12-25-18)19(13-5-2-1-3-6-13)15-7-4-10-23-21(15)24-20/h1-11H,12H2
InChIKeyZKRYJIKRNQPCIG-UHFFFAOYSA-N
XLogP5.00
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.35
LogP ≤ 55.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

6-[(2-Benzyloxy-5-methoxy-phenyl)methyl]-5-methyl-pyrido[2,3-d]pyrimidine-2,4-diamine
CID 6481089
3-({6-[4-(Trifluoromethyl)phenyl]pyrimidin-4-yl}oxy)isoquinoline
CID 9976219
5-({6-[4-(Trifluoromethyl)phenyl]pyrimidin-4-yl}oxy)quinoline
CID 10338944
8-({6-[4-(Trifluoromethyl)phenyl]pyrimidin-4-yl}oxy)isoquinoline
CID 10384316
5-({6-[4-(Trifluoromethyl)phenyl]pyrimidin-4-yl}oxy)isoquinoline
CID 10406636
7-({6-[4-(Trifluoromethyl)phenyl]pyrimidin-4-yl}oxy)isoquinoline
CID 10429017
7-({6-[4-(Trifluoromethyl)phenyl]pyrimidin-4-yl}oxy)quinoline
CID 10429018
6-Amino-2-(4-fluorophenyl)-4-benzyloxy-3-(4-pyridyl)-1h-pyrrolo[2,3-b]pyridine
CID 10386848
4-(4-Methoxyphenoxy)-2-(pyridin-3-yl)quinazoline
CID 719310
4-Phenoxy-2-pyridin-3-ylquinazoline
CID 872375
2-(3,5-Dimethoxyphenyl)-1,8-naphthyridine
CID 44434719
6-(2-Methoxyphenyl)-N~4~,N~4~-Bis[(Pyridin-2-Yl)methyl]pyrimidine-2,4-Diamine
CID 124220260

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-7-phenyl-6H-chromeno[4,3-b][1,8]naphthyridine?
The IUPAC name of 2-fluoro-7-phenyl-6H-chromeno[4,3-b][1,8]naphthyridine (CID 164619317) is 2-fluoro-7-phenyl-6H-chromeno[4,3-b][1,8]naphthyridine.
What is the SMILES notation for 2-fluoro-7-phenyl-6H-chromeno[4,3-b][1,8]naphthyridine?
The canonical SMILES for 2-fluoro-7-phenyl-6H-chromeno[4,3-b][1,8]naphthyridine is Fc1ccc2c(c1)-c1nc3ncccc3c(-c3ccccc3)c1CO2.
What is the InChIKey of 2-fluoro-7-phenyl-6H-chromeno[4,3-b][1,8]naphthyridine?
The InChIKey is ZKRYJIKRNQPCIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H13FN2O/c22-14-8-9-18-16(11-14)20-17(12-25-18)19(13-5-2-1-3-6-13)15-7-4-10-23-21(15)24-20/h1-11H,12H2.
What are the key properties of 2-fluoro-7-phenyl-6H-chromeno[4,3-b][1,8]naphthyridine?
2-fluoro-7-phenyl-6H-chromeno[4,3-b][1,8]naphthyridine has a molecular weight of 328.35 g/mol, XLogP of 5.00, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-7-phenyl-6H-chromeno[4,3-b][1,8]naphthyridine is sourced from PubChem (CID 164619317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).