N-(5-(trifluoromethyl)pyridin-2-yl)-7-(3-(trifluoromethyl)pyridin-4-yl)-1,8-naphthyridin-4-amine

C20H11F6N5 — CID 49863826

IUPAC7-[3-(trifluoromethyl)-4-pyridinyl]-N-[5-(trifluoromethyl)-2-pyridinyl]-1,8-naphthyridin-4-amine
SMILESC1=CC(=NC=C1C(F)(F)F)NC2=C3C=CC(=NC3=NC=C2)C4=C(C=NC=C4)C(F)(F)F
InChIInChI=1S/C20H11F6N5/c21-19(22,23)11-1-4-17(29-9-11)30-16-6-8-28-18-13(16)2-3-15(31-18)12-5-7-27-10-14(12)20(24,25)26/h1-10H,(H,28,29,30,31)
InChIKeyZCDNRXVTKQTZEV-UHFFFAOYSA-N
MW435.30 g/mol
LogP4.60
Rot. Bonds3

About N-(5-(trifluoromethyl)pyridin-2-yl)-7-(3-(trifluoromethyl)pyridin-4-yl)-1,8-naphthyridin-4-amine

N-(5-(trifluoromethyl)pyridin-2-yl)-7-(3-(trifluoromethyl)pyridin-4-yl)-1,8-naphthyridin-4-amine (PubChem CID 49863826) has the molecular formula C20H11F6N5 and a molecular weight of 435.30 g/mol. Its IUPAC name is 7-[3-(trifluoromethyl)-4-pyridinyl]-N-[5-(trifluoromethyl)-2-pyridinyl]-1,8-naphthyridin-4-amine.

Molecular Properties

Compound NameN-(5-(trifluoromethyl)pyridin-2-yl)-7-(3-(trifluoromethyl)pyridin-4-yl)-1,8-naphthyridin-4-amine
PubChem CID49863826
Molecular FormulaC20H11F6N5
Molecular Weight435.30 g/mol
Exact Mass435.09
IUPAC Name7-[3-(trifluoromethyl)-4-pyridinyl]-N-[5-(trifluoromethyl)-2-pyridinyl]-1,8-naphthyridin-4-amine
SMILESC1=CC(=NC=C1C(F)(F)F)NC2=C3C=CC(=NC3=NC=C2)C4=C(C=NC=C4)C(F)(F)F
InChIInChI=1S/C20H11F6N5/c21-19(22,23)11-1-4-17(29-9-11)30-16-6-8-28-18-13(16)2-3-15(31-18)12-5-7-27-10-14(12)20(24,25)26/h1-10H,(H,28,29,30,31)
InChIKeyZCDNRXVTKQTZEV-UHFFFAOYSA-N
XLogP4.60
TPSA63.60 Ų
H-Bond Donors1
H-Bond Acceptors11
Rotatable Bonds3
Heavy Atoms31
Complexity600

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500435.30
LogP ≤ 54.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1011

Analyze N-(5-(trifluoromethyl)pyridin-2-yl)-7-(3-(trifluoromethyl)pyridin-4-yl)-1,8-naphthyridin-4-amine with MolForge

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Related Compounds

Ngd-8243
CID 11247522
Jnj-38893777
CID 16742146
(4-tert-Butyl-phenyl)-[7-(3-trifluoromethyl-pyridin-2-yl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-d]azepin-4-yl]-amine
CID 24782891
2-isopropyl-7-(3-(trifluoromethyl)pyridin-2-yl)-N-(5-(trifluoromethyl)pyridin-2-yl)-6,7,8,9-tetrahydro-5H-pyrimido[5,4-d]azepin-4-amine
CID 52949700
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CID 446752
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CID 10248318
Cyclohexyl-(4-(1-piperazin-1-yl(2,6)naphthyridin-3-yl)pyridin-2-yl)amine
CID 25020250
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CID 67983123
N-(3-fluoropyridin-4-yl)-2-[6-(trifluoromethyl)pyridin-2-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine
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CID 667555
2-(6-methylpyridin-2-yl)-N-(pyridin-4-yl)quinazolin-4-amine
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CID 921562

Frequently Asked Questions

What is the IUPAC name of N-(5-(trifluoromethyl)pyridin-2-yl)-7-(3-(trifluoromethyl)pyridin-4-yl)-1,8-naphthyridin-4-amine?
The IUPAC name of N-(5-(trifluoromethyl)pyridin-2-yl)-7-(3-(trifluoromethyl)pyridin-4-yl)-1,8-naphthyridin-4-amine (CID 49863826) is 7-[3-(trifluoromethyl)-4-pyridinyl]-N-[5-(trifluoromethyl)-2-pyridinyl]-1,8-naphthyridin-4-amine.
What is the SMILES notation for N-(5-(trifluoromethyl)pyridin-2-yl)-7-(3-(trifluoromethyl)pyridin-4-yl)-1,8-naphthyridin-4-amine?
The canonical SMILES for N-(5-(trifluoromethyl)pyridin-2-yl)-7-(3-(trifluoromethyl)pyridin-4-yl)-1,8-naphthyridin-4-amine is C1=CC(=NC=C1C(F)(F)F)NC2=C3C=CC(=NC3=NC=C2)C4=C(C=NC=C4)C(F)(F)F.
What is the InChIKey of N-(5-(trifluoromethyl)pyridin-2-yl)-7-(3-(trifluoromethyl)pyridin-4-yl)-1,8-naphthyridin-4-amine?
The InChIKey is ZCDNRXVTKQTZEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H11F6N5/c21-19(22,23)11-1-4-17(29-9-11)30-16-6-8-28-18-13(16)2-3-15(31-18)12-5-7-27-10-14(12)20(24,25)26/h1-10H,(H,28,29,30,31).
What are the key properties of N-(5-(trifluoromethyl)pyridin-2-yl)-7-(3-(trifluoromethyl)pyridin-4-yl)-1,8-naphthyridin-4-amine?
N-(5-(trifluoromethyl)pyridin-2-yl)-7-(3-(trifluoromethyl)pyridin-4-yl)-1,8-naphthyridin-4-amine has a molecular weight of 435.30 g/mol, XLogP of 4.60, 3 rotatable bonds, 1 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-(trifluoromethyl)pyridin-2-yl)-7-(3-(trifluoromethyl)pyridin-4-yl)-1,8-naphthyridin-4-amine is sourced from PubChem (CID 49863826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).