7-benzyl-2-(trifluoromethyl)-6,8-dihydro-5H-1,7-naphthyridine

C16H15F3N2 — CID 71304006

IUPAC7-benzyl-2-(trifluoromethyl)-6,8-dihydro-5H-1,7-naphthyridine
SMILESFC(F)(F)c1ccc2c(n1)CN(Cc1ccccc1)CC2
InChIInChI=1S/C16H15F3N2/c17-16(18,19)15-7-6-13-8-9-21(11-14(13)20-15)10-12-4-2-1-3-5-12/h1-7H,8-11H2
InChIKeyNYEBGBPLHYNMJI-UHFFFAOYSA-N
MW292.30 g/mol
LogP3.66
Rot. Bonds2

About 7-benzyl-2-(trifluoromethyl)-6,8-dihydro-5H-1,7-naphthyridine

7-benzyl-2-(trifluoromethyl)-6,8-dihydro-5H-1,7-naphthyridine (PubChem CID 71304006) has the molecular formula C16H15F3N2 and a molecular weight of 292.30 g/mol. Its IUPAC name is 7-benzyl-2-(trifluoromethyl)-6,8-dihydro-5H-1,7-naphthyridine.

Molecular Properties

Compound Name7-benzyl-2-(trifluoromethyl)-6,8-dihydro-5H-1,7-naphthyridine
PubChem CID71304006
Molecular FormulaC16H15F3N2
Molecular Weight292.30 g/mol
Exact Mass292.12
IUPAC Name7-benzyl-2-(trifluoromethyl)-6,8-dihydro-5H-1,7-naphthyridine
SMILESFC(F)(F)c1ccc2c(n1)CN(Cc1ccccc1)CC2
InChIInChI=1S/C16H15F3N2/c17-16(18,19)15-7-6-13-8-9-21(11-14(13)20-15)10-12-4-2-1-3-5-12/h1-7H,8-11H2
InChIKeyNYEBGBPLHYNMJI-UHFFFAOYSA-N
XLogP3.66
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.30
LogP ≤ 53.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

CID 172756163
CID 172756163
2-pyridin-2-yl-7-[[6-(trifluoromethyl)-3-pyridinyl]methyl]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine
CID 24931585
6-benzyl-7,8-dihydro-5H-1,6-naphthyridine-2-carboxylic acid
CID 46839896
4-benzyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]-1,4-diazepan-5-one
CID 24733018
6-benzyl-2-methylsulfanyl-5,7,8,9-tetrahydropyrido[3,2-c]azepine
CID 70857995
1,4,7,10-tetrabenzyl-1,4,7,10-tetrazacyclododecane
CID 160853215
2-benzyl-6-ethyl-3,4-dihydro-1H-isoquinoline
CID 15519082
2-benzyl-3,4-dihydro-1H-isoquinolin-7-amine;hydrochloride
CID 23298431
6-benzyl-2-(4-methylpiperazin-1-yl)-7,8-dihydro-5H-1,6-naphthyridine
CID 22335156
2-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[b]pyridine
CID 131131432
2-benzyl-1,3,4,5-tetrahydro-2-benzazepine;dihydrochloride
CID 142634815
6-methylsulfonyl-2-[[4-(trifluoromethyl)phenyl]methyl]-3,4-dihydro-1H-isoquinoline
CID 118922461

Frequently Asked Questions

What is the IUPAC name of 7-benzyl-2-(trifluoromethyl)-6,8-dihydro-5H-1,7-naphthyridine?
The IUPAC name of 7-benzyl-2-(trifluoromethyl)-6,8-dihydro-5H-1,7-naphthyridine (CID 71304006) is 7-benzyl-2-(trifluoromethyl)-6,8-dihydro-5H-1,7-naphthyridine.
What is the SMILES notation for 7-benzyl-2-(trifluoromethyl)-6,8-dihydro-5H-1,7-naphthyridine?
The canonical SMILES for 7-benzyl-2-(trifluoromethyl)-6,8-dihydro-5H-1,7-naphthyridine is FC(F)(F)c1ccc2c(n1)CN(Cc1ccccc1)CC2.
What is the InChIKey of 7-benzyl-2-(trifluoromethyl)-6,8-dihydro-5H-1,7-naphthyridine?
The InChIKey is NYEBGBPLHYNMJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15F3N2/c17-16(18,19)15-7-6-13-8-9-21(11-14(13)20-15)10-12-4-2-1-3-5-12/h1-7H,8-11H2.
What are the key properties of 7-benzyl-2-(trifluoromethyl)-6,8-dihydro-5H-1,7-naphthyridine?
7-benzyl-2-(trifluoromethyl)-6,8-dihydro-5H-1,7-naphthyridine has a molecular weight of 292.30 g/mol, XLogP of 3.66, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-benzyl-2-(trifluoromethyl)-6,8-dihydro-5H-1,7-naphthyridine is sourced from PubChem (CID 71304006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).