7-fluoro-2-methoxy-8-(2-phenylethyl)-1,5-naphthyridine

C17H15FN2O — CID 141180436

IUPAC7-fluoro-2-methoxy-8-(2-phenylethyl)-1,5-naphthyridine
SMILESCOc1ccc2ncc(F)c(CCc3ccccc3)c2n1
InChIInChI=1S/C17H15FN2O/c1-21-16-10-9-15-17(20-16)13(14(18)11-19-15)8-7-12-5-3-2-4-6-12/h2-6,9-11H,7-8H2,1H3
InChIKeyYKVPCCZYQXYFDH-UHFFFAOYSA-N
MW282.32 g/mol
LogP3.56
Rot. Bonds4

About 7-fluoro-2-methoxy-8-(2-phenylethyl)-1,5-naphthyridine

7-fluoro-2-methoxy-8-(2-phenylethyl)-1,5-naphthyridine (PubChem CID 141180436) has the molecular formula C17H15FN2O and a molecular weight of 282.32 g/mol. Its IUPAC name is 7-fluoro-2-methoxy-8-(2-phenylethyl)-1,5-naphthyridine.

Molecular Properties

Compound Name7-fluoro-2-methoxy-8-(2-phenylethyl)-1,5-naphthyridine
PubChem CID141180436
Molecular FormulaC17H15FN2O
Molecular Weight282.32 g/mol
Exact Mass282.12
IUPAC Name7-fluoro-2-methoxy-8-(2-phenylethyl)-1,5-naphthyridine
SMILESCOc1ccc2ncc(F)c(CCc3ccccc3)c2n1
InChIInChI=1S/C17H15FN2O/c1-21-16-10-9-15-17(20-16)13(14(18)11-19-15)8-7-12-5-3-2-4-6-12/h2-6,9-11H,7-8H2,1H3
InChIKeyYKVPCCZYQXYFDH-UHFFFAOYSA-N
XLogP3.56
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.32
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

8-[2-[(3aR,6aS)-5-benzyl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-2-yl]ethyl]-7-fluoro-2-methoxy-1,5-naphthyridine
CID 59011512
2-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)ethyl]-1,3-dioxan-5-amine
CID 146503167
8-[2-(3-azabicyclo[3.2.0]heptan-3-yl)ethyl]-7-fluoro-2-methoxy-1,5-naphthyridine
CID 143269696
4-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)ethyl]bicyclo[2.2.1]heptan-1-amine
CID 71152906
benzyl-[[(3S)-1-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)ethyl]pyrrolidin-3-yl]methyl]carbamic acid
CID 68576913
benzyl N-[[(3R,4S)-1-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)ethyl]-4-hydroxypyrrolidin-3-yl]methyl]carbamate
CID 131728028
1-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)-1-methoxyethyl]-2-oxabicyclo[2.2.2]octan-4-amine
CID 71151201
6-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)ethyl]piperidin-3-amine
CID 141165400
N-[(3,4-difluorophenyl)methyl]-2-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)ethyl]-1,3-dioxan-5-amine
CID 146503160
(3aR,4R,6aS)-2-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)ethyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-4-amine
CID 59011507
1-[(3R)-1-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)ethyl]pyrrolidin-3-yl]ethanamine
CID 70898198
3-(aminomethyl)-1-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)ethyl]pyrrolidin-3-ol
CID 68576770

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-2-methoxy-8-(2-phenylethyl)-1,5-naphthyridine?
The IUPAC name of 7-fluoro-2-methoxy-8-(2-phenylethyl)-1,5-naphthyridine (CID 141180436) is 7-fluoro-2-methoxy-8-(2-phenylethyl)-1,5-naphthyridine.
What is the SMILES notation for 7-fluoro-2-methoxy-8-(2-phenylethyl)-1,5-naphthyridine?
The canonical SMILES for 7-fluoro-2-methoxy-8-(2-phenylethyl)-1,5-naphthyridine is COc1ccc2ncc(F)c(CCc3ccccc3)c2n1.
What is the InChIKey of 7-fluoro-2-methoxy-8-(2-phenylethyl)-1,5-naphthyridine?
The InChIKey is YKVPCCZYQXYFDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15FN2O/c1-21-16-10-9-15-17(20-16)13(14(18)11-19-15)8-7-12-5-3-2-4-6-12/h2-6,9-11H,7-8H2,1H3.
What are the key properties of 7-fluoro-2-methoxy-8-(2-phenylethyl)-1,5-naphthyridine?
7-fluoro-2-methoxy-8-(2-phenylethyl)-1,5-naphthyridine has a molecular weight of 282.32 g/mol, XLogP of 3.56, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-2-methoxy-8-(2-phenylethyl)-1,5-naphthyridine is sourced from PubChem (CID 141180436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).