1-[(2,5-difluorophenyl)methyl]-3,4-dihydro-2H-1,8-naphthyridine

C15H14F2N2 — CID 172712438

IUPAC1-[(2,5-difluorophenyl)methyl]-3,4-dihydro-2H-1,8-naphthyridine
SMILESFc1ccc(F)c(CN2CCCc3cccnc32)c1
InChIInChI=1S/C15H14F2N2/c16-13-5-6-14(17)12(9-13)10-19-8-2-4-11-3-1-7-18-15(11)19/h1,3,5-7,9H,2,4,8,10H2
InChIKeyFKQQFQGWPQYENF-UHFFFAOYSA-N
MW260.29 g/mol
LogP3.31
Rot. Bonds2

About 1-[(2,5-difluorophenyl)methyl]-3,4-dihydro-2H-1,8-naphthyridine

1-[(2,5-difluorophenyl)methyl]-3,4-dihydro-2H-1,8-naphthyridine (PubChem CID 172712438) has the molecular formula C15H14F2N2 and a molecular weight of 260.29 g/mol. Its IUPAC name is 1-[(2,5-difluorophenyl)methyl]-3,4-dihydro-2H-1,8-naphthyridine.

Molecular Properties

Compound Name1-[(2,5-difluorophenyl)methyl]-3,4-dihydro-2H-1,8-naphthyridine
PubChem CID172712438
Molecular FormulaC15H14F2N2
Molecular Weight260.29 g/mol
Exact Mass260.11
IUPAC Name1-[(2,5-difluorophenyl)methyl]-3,4-dihydro-2H-1,8-naphthyridine
SMILESFc1ccc(F)c(CN2CCCc3cccnc32)c1
InChIInChI=1S/C15H14F2N2/c16-13-5-6-14(17)12(9-13)10-19-8-2-4-11-3-1-7-18-15(11)19/h1,3,5-7,9H,2,4,8,10H2
InChIKeyFKQQFQGWPQYENF-UHFFFAOYSA-N
XLogP3.31
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.29
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(2-bromo-4-fluorophenyl)methyl]-3,4-dihydro-2H-quinoline
CID 63462245
1-[5-[(2,5-difluorophenyl)methyl]-7,8-dihydro-6H-pyrido[2,3-b]pyrazin-3-yl]-4-thiophen-2-ylbutan-1-one
CID 58523693
ethane;1-methyl-3,4-dihydro-2H-1,8-naphthyridine
CID 91237685
1-[(2,5-difluorophenyl)methyl]-3-(2-methoxy-3-pyridinyl)-6,7-dihydro-5H-cyclopenta[f]indole-2-carbaldehyde
CID 88563172
[4-(3,4-dihydro-2H-1,8-naphthyridin-1-yl)-2-fluorophenyl]-methyldiazene
CID 166887258
2-(3,4-dihydro-2H-quinolin-1-ylmethyl)-5-fluorobenzenecarbothioamide
CID 63293058
2-[(2,5-difluorophenyl)methyl]-3,4-dihydro-1H-isoquinolin-5-amine
CID 61019122
[3-(3,4-dihydro-2H-quinolin-1-ylmethyl)-2-pyridinyl]hydrazine
CID 62471565
2-[(2,5-difluorophenyl)methyl]-7-iodo-3,4-dihydroisoquinolin-1-one
CID 79781440
1-[(4-bromo-2-fluorophenyl)methyl]-3,4-dihydro-2H-quinoline
CID 60644856
1-[[3-(trifluoromethyl)-2-pyridinyl]methyl]-3,4-dihydro-2H-quinoline
CID 75398516
1-[(2,5-difluorophenyl)methyl]-2-methyl-3-[[2-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]guanidine;hydroiodide
CID 111902648

Frequently Asked Questions

What is the IUPAC name of 1-[(2,5-difluorophenyl)methyl]-3,4-dihydro-2H-1,8-naphthyridine?
The IUPAC name of 1-[(2,5-difluorophenyl)methyl]-3,4-dihydro-2H-1,8-naphthyridine (CID 172712438) is 1-[(2,5-difluorophenyl)methyl]-3,4-dihydro-2H-1,8-naphthyridine.
What is the SMILES notation for 1-[(2,5-difluorophenyl)methyl]-3,4-dihydro-2H-1,8-naphthyridine?
The canonical SMILES for 1-[(2,5-difluorophenyl)methyl]-3,4-dihydro-2H-1,8-naphthyridine is Fc1ccc(F)c(CN2CCCc3cccnc32)c1.
What is the InChIKey of 1-[(2,5-difluorophenyl)methyl]-3,4-dihydro-2H-1,8-naphthyridine?
The InChIKey is FKQQFQGWPQYENF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F2N2/c16-13-5-6-14(17)12(9-13)10-19-8-2-4-11-3-1-7-18-15(11)19/h1,3,5-7,9H,2,4,8,10H2.
What are the key properties of 1-[(2,5-difluorophenyl)methyl]-3,4-dihydro-2H-1,8-naphthyridine?
1-[(2,5-difluorophenyl)methyl]-3,4-dihydro-2H-1,8-naphthyridine has a molecular weight of 260.29 g/mol, XLogP of 3.31, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2,5-difluorophenyl)methyl]-3,4-dihydro-2H-1,8-naphthyridine is sourced from PubChem (CID 172712438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).