N-benzyl-2-(3-fluorophenyl)-1,6-naphthyridin-5-amine

C21H16FN3 — CID 71618008

IUPACN-benzyl-2-(3-fluorophenyl)-1,6-naphthyridin-5-amine
SMILESFc1cccc(-c2ccc3c(NCc4ccccc4)nccc3n2)c1
InChIInChI=1S/C21H16FN3/c22-17-8-4-7-16(13-17)19-10-9-18-20(25-19)11-12-23-21(18)24-14-15-5-2-1-3-6-15/h1-13H,14H2,(H,23,24)
InChIKeyOIIWJNXBHPTISP-UHFFFAOYSA-N
MW329.38 g/mol
LogP5.05
Rot. Bonds4

About N-benzyl-2-(3-fluorophenyl)-1,6-naphthyridin-5-amine

N-benzyl-2-(3-fluorophenyl)-1,6-naphthyridin-5-amine (PubChem CID 71618008) has the molecular formula C21H16FN3 and a molecular weight of 329.38 g/mol. Its IUPAC name is N-benzyl-2-(3-fluorophenyl)-1,6-naphthyridin-5-amine.

Molecular Properties

Compound NameN-benzyl-2-(3-fluorophenyl)-1,6-naphthyridin-5-amine
PubChem CID71618008
Molecular FormulaC21H16FN3
Molecular Weight329.38 g/mol
Exact Mass329.13
IUPAC NameN-benzyl-2-(3-fluorophenyl)-1,6-naphthyridin-5-amine
SMILESFc1cccc(-c2ccc3c(NCc4ccccc4)nccc3n2)c1
InChIInChI=1S/C21H16FN3/c22-17-8-4-7-16(13-17)19-10-9-18-20(25-19)11-12-23-21(18)24-14-15-5-2-1-3-6-15/h1-13H,14H2,(H,23,24)
InChIKeyOIIWJNXBHPTISP-UHFFFAOYSA-N
XLogP5.05
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500329.38
LogP ≤ 55.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-(3-fluorophenyl)-N-[[6-(3-fluorophenyl)-3-pyridinyl]methyl]-2,7-naphthyridin-1-amine
CID 118634314
6-(3-fluorophenyl)-N-(pyridin-3-ylmethyl)-2,7-naphthyridin-1-amine
CID 175829223
N-benzyl-2-(3-fluorophenyl)quinolin-5-amine;2-(3-fluorophenyl)-N-[[6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]quinolin-5-amine;bis(N-[(4-methylphenyl)methyl]-6-(2-methyl-4-pyridinyl)-2,7-naphthyridin-1-amine);6-(2-methyl-4-pyridinyl)-N-(pyridin-3-ylmethyl)-2,7-naphthyridin-1-amine
CID 161348397
N-[[4-(3-fluorophenyl)phenyl]methyl]-7-(2-methyl-4-pyridinyl)quinazolin-4-amine
CID 57413686
6-(3-fluorophenyl)-N-[[6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]isoquinolin-1-amine;N-[[3-methyl-4-(2-methyl-4-pyridinyl)phenyl]methyl]-6-(2-methyl-4-pyridinyl)-2,7-naphthyridin-1-amine;2-(2-methyl-4-pyridinyl)-N-[[4-(2-methyl-4-pyridinyl)phenyl]methyl]-1,6-naphthyridin-5-amine;6-(2-methyl-4-pyridinyl)-N-[[4-(2-methyl-4-pyridinyl)phenyl]methyl]-2,7-naphthyridin-1-amine;N-[[4-(2-methyl-4-pyridinyl)phenyl]methyl]-2-phenylpyrido[3,4-b]pyrazin-5-amine;N-[[4-(2-methyl-4-pyridinyl)phenyl]methyl]-6-pyridin-4-yl-2,7-naphthyridin-1-amine
CID 158242100
N-benzyl-7-fluoro-2-pyridin-3-ylquinazolin-4-amine;dihydrochloride
CID 19392183
N-[(3-fluorophenyl)methyl]-2-methylquinazolin-4-amine
CID 69221219
N-[(3-fluorophenyl)methyl]furo[3,2-c]pyridin-4-amine
CID 103702615
2-(2-methyl-4-pyridinyl)-N-[[6-(2-methyl-4-pyridinyl)-4,5-didehydropyridin-3-yl]methyl]-1,6-naphthyridin-5-amine
CID 123842294
2-(2-methyl-4-pyridinyl)-N-[2-[4-(2-methyl-4-pyridinyl)phenyl]ethyl]-1,6-naphthyridin-5-amine
CID 174650686
6-(3-chlorophenyl)-N-[[4-(2-methyl-4-pyridinyl)phenyl]methyl]-2,7-naphthyridin-1-amine;6-(3-fluorophenyl)-N-[[4-(2-methyl-4-pyridinyl)phenyl]methyl]-2,7-naphthyridin-1-amine;6-(3-fluorophenyl)-N-[[6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]-2,7-naphthyridin-1-amine;6-(3-fluorophenyl)-N-[[4-[2-(trifluoromethyl)-4-pyridinyl]phenyl]methyl]-2,7-naphthyridin-1-amine;N-[[4-(2-methyl-4-pyridinyl)phenyl]methyl]-6-phenyl-2,7-naphthyridin-1-amine
CID 161183960
2-chloro-N-[(3-fluorophenyl)methyl]-5-phenylquinazolin-4-amine
CID 88886857

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-(3-fluorophenyl)-1,6-naphthyridin-5-amine?
The IUPAC name of N-benzyl-2-(3-fluorophenyl)-1,6-naphthyridin-5-amine (CID 71618008) is N-benzyl-2-(3-fluorophenyl)-1,6-naphthyridin-5-amine.
What is the SMILES notation for N-benzyl-2-(3-fluorophenyl)-1,6-naphthyridin-5-amine?
The canonical SMILES for N-benzyl-2-(3-fluorophenyl)-1,6-naphthyridin-5-amine is Fc1cccc(-c2ccc3c(NCc4ccccc4)nccc3n2)c1.
What is the InChIKey of N-benzyl-2-(3-fluorophenyl)-1,6-naphthyridin-5-amine?
The InChIKey is OIIWJNXBHPTISP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16FN3/c22-17-8-4-7-16(13-17)19-10-9-18-20(25-19)11-12-23-21(18)24-14-15-5-2-1-3-6-15/h1-13H,14H2,(H,23,24).
What are the key properties of N-benzyl-2-(3-fluorophenyl)-1,6-naphthyridin-5-amine?
N-benzyl-2-(3-fluorophenyl)-1,6-naphthyridin-5-amine has a molecular weight of 329.38 g/mol, XLogP of 5.05, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-(3-fluorophenyl)-1,6-naphthyridin-5-amine is sourced from PubChem (CID 71618008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).