2-pyridin-4-yl-N-[1-(trifluoromethyl)cyclobutyl]-1,7-naphthyridin-4-amine

C18H15F3N4 — CID 135390658

IUPAC2-pyridin-4-yl-N-[1-(trifluoromethyl)cyclobutyl]-1,7-naphthyridin-4-amine
SMILESFC(F)(F)C1(Nc2cc(-c3ccncc3)nc3cnccc23)CCC1
InChIInChI=1S/C18H15F3N4/c19-18(20,21)17(5-1-6-17)25-15-10-14(12-2-7-22-8-3-12)24-16-11-23-9-4-13(15)16/h2-4,7-11H,1,5-6H2,(H,24,25)
InChIKeyLQDZLEIPLPPQBB-UHFFFAOYSA-N
MW344.34 g/mol
LogP4.59
Rot. Bonds3

About 2-pyridin-4-yl-N-[1-(trifluoromethyl)cyclobutyl]-1,7-naphthyridin-4-amine

2-pyridin-4-yl-N-[1-(trifluoromethyl)cyclobutyl]-1,7-naphthyridin-4-amine (PubChem CID 135390658) has the molecular formula C18H15F3N4 and a molecular weight of 344.34 g/mol. Its IUPAC name is 2-pyridin-4-yl-N-[1-(trifluoromethyl)cyclobutyl]-1,7-naphthyridin-4-amine.

Molecular Properties

Compound Name2-pyridin-4-yl-N-[1-(trifluoromethyl)cyclobutyl]-1,7-naphthyridin-4-amine
PubChem CID135390658
Molecular FormulaC18H15F3N4
Molecular Weight344.34 g/mol
Exact Mass344.12
IUPAC Name2-pyridin-4-yl-N-[1-(trifluoromethyl)cyclobutyl]-1,7-naphthyridin-4-amine
SMILESFC(F)(F)C1(Nc2cc(-c3ccncc3)nc3cnccc23)CCC1
InChIInChI=1S/C18H15F3N4/c19-18(20,21)17(5-1-6-17)25-15-10-14(12-2-7-22-8-3-12)24-16-11-23-9-4-13(15)16/h2-4,7-11H,1,5-6H2,(H,24,25)
InChIKeyLQDZLEIPLPPQBB-UHFFFAOYSA-N
XLogP4.59
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.34
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-pyridin-4-yl-N-[1-(trifluoromethyl)cyclobutyl]-1,7-naphthyridin-4-amine?
The IUPAC name of 2-pyridin-4-yl-N-[1-(trifluoromethyl)cyclobutyl]-1,7-naphthyridin-4-amine (CID 135390658) is 2-pyridin-4-yl-N-[1-(trifluoromethyl)cyclobutyl]-1,7-naphthyridin-4-amine.
What is the SMILES notation for 2-pyridin-4-yl-N-[1-(trifluoromethyl)cyclobutyl]-1,7-naphthyridin-4-amine?
The canonical SMILES for 2-pyridin-4-yl-N-[1-(trifluoromethyl)cyclobutyl]-1,7-naphthyridin-4-amine is FC(F)(F)C1(Nc2cc(-c3ccncc3)nc3cnccc23)CCC1.
What is the InChIKey of 2-pyridin-4-yl-N-[1-(trifluoromethyl)cyclobutyl]-1,7-naphthyridin-4-amine?
The InChIKey is LQDZLEIPLPPQBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15F3N4/c19-18(20,21)17(5-1-6-17)25-15-10-14(12-2-7-22-8-3-12)24-16-11-23-9-4-13(15)16/h2-4,7-11H,1,5-6H2,(H,24,25).
What are the key properties of 2-pyridin-4-yl-N-[1-(trifluoromethyl)cyclobutyl]-1,7-naphthyridin-4-amine?
2-pyridin-4-yl-N-[1-(trifluoromethyl)cyclobutyl]-1,7-naphthyridin-4-amine has a molecular weight of 344.34 g/mol, XLogP of 4.59, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyridin-4-yl-N-[1-(trifluoromethyl)cyclobutyl]-1,7-naphthyridin-4-amine is sourced from PubChem (CID 135390658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).