N-[5-cyclopentyloxy-7-(5-fluoro-2-methylphenyl)-2,6-naphthyridin-3-yl]cyclopropanecarboxamide

C24H24FN3O2 — CID 71114980

IUPACN-[5-cyclopentyloxy-7-(5-fluoro-2-methylphenyl)-2,6-naphthyridin-3-yl]cyclopropanecarboxamide
SMILESCc1ccc(F)cc1-c1cc2cnc(NC(=O)C3CC3)cc2c(OC2CCCC2)n1
InChIInChI=1S/C24H24FN3O2/c1-14-6-9-17(25)11-19(14)21-10-16-13-26-22(28-23(29)15-7-8-15)12-20(16)24(27-21)30-18-4-2-3-5-18/h6,9-13,15,18H,2-5,7-8H2,1H3,(H,26,28,29)
InChIKeyJZFPVXZUCJMHBJ-UHFFFAOYSA-N
MW405.47 g/mol
LogP5.41
Rot. Bonds5

About N-[5-cyclopentyloxy-7-(5-fluoro-2-methylphenyl)-2,6-naphthyridin-3-yl]cyclopropanecarboxamide

N-[5-cyclopentyloxy-7-(5-fluoro-2-methylphenyl)-2,6-naphthyridin-3-yl]cyclopropanecarboxamide (PubChem CID 71114980) has the molecular formula C24H24FN3O2 and a molecular weight of 405.47 g/mol. Its IUPAC name is N-[5-cyclopentyloxy-7-(5-fluoro-2-methylphenyl)-2,6-naphthyridin-3-yl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[5-cyclopentyloxy-7-(5-fluoro-2-methylphenyl)-2,6-naphthyridin-3-yl]cyclopropanecarboxamide
PubChem CID71114980
Molecular FormulaC24H24FN3O2
Molecular Weight405.47 g/mol
Exact Mass405.19
IUPAC NameN-[5-cyclopentyloxy-7-(5-fluoro-2-methylphenyl)-2,6-naphthyridin-3-yl]cyclopropanecarboxamide
SMILESCc1ccc(F)cc1-c1cc2cnc(NC(=O)C3CC3)cc2c(OC2CCCC2)n1
InChIInChI=1S/C24H24FN3O2/c1-14-6-9-17(25)11-19(14)21-10-16-13-26-22(28-23(29)15-7-8-15)12-20(16)24(27-21)30-18-4-2-3-5-18/h6,9-13,15,18H,2-5,7-8H2,1H3,(H,26,28,29)
InChIKeyJZFPVXZUCJMHBJ-UHFFFAOYSA-N
XLogP5.41
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500405.47
LogP ≤ 55.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[5-cyclopentyloxy-7-(5-fluoro-2-methylphenyl)-2,6-naphthyridin-3-yl]cyclopropanecarboxamide?
The IUPAC name of N-[5-cyclopentyloxy-7-(5-fluoro-2-methylphenyl)-2,6-naphthyridin-3-yl]cyclopropanecarboxamide (CID 71114980) is N-[5-cyclopentyloxy-7-(5-fluoro-2-methylphenyl)-2,6-naphthyridin-3-yl]cyclopropanecarboxamide.
What is the SMILES notation for N-[5-cyclopentyloxy-7-(5-fluoro-2-methylphenyl)-2,6-naphthyridin-3-yl]cyclopropanecarboxamide?
The canonical SMILES for N-[5-cyclopentyloxy-7-(5-fluoro-2-methylphenyl)-2,6-naphthyridin-3-yl]cyclopropanecarboxamide is Cc1ccc(F)cc1-c1cc2cnc(NC(=O)C3CC3)cc2c(OC2CCCC2)n1.
What is the InChIKey of N-[5-cyclopentyloxy-7-(5-fluoro-2-methylphenyl)-2,6-naphthyridin-3-yl]cyclopropanecarboxamide?
The InChIKey is JZFPVXZUCJMHBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24FN3O2/c1-14-6-9-17(25)11-19(14)21-10-16-13-26-22(28-23(29)15-7-8-15)12-20(16)24(27-21)30-18-4-2-3-5-18/h6,9-13,15,18H,2-5,7-8H2,1H3,(H,26,28,29).
What are the key properties of N-[5-cyclopentyloxy-7-(5-fluoro-2-methylphenyl)-2,6-naphthyridin-3-yl]cyclopropanecarboxamide?
N-[5-cyclopentyloxy-7-(5-fluoro-2-methylphenyl)-2,6-naphthyridin-3-yl]cyclopropanecarboxamide has a molecular weight of 405.47 g/mol, XLogP of 5.41, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-cyclopentyloxy-7-(5-fluoro-2-methylphenyl)-2,6-naphthyridin-3-yl]cyclopropanecarboxamide is sourced from PubChem (CID 71114980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).