2-(5-chloro-2-fluorophenyl)-N-(2-chloro-4-pyridinyl)-1,8-naphthyridin-4-amine

C19H11Cl2FN4 — CID 88913140

IUPAC2-(5-chloro-2-fluorophenyl)-N-(2-chloro-4-pyridinyl)-1,8-naphthyridin-4-amine
SMILESFc1ccc(Cl)cc1-c1cc(Nc2ccnc(Cl)c2)c2cccnc2n1
InChIInChI=1S/C19H11Cl2FN4/c20-11-3-4-15(22)14(8-11)17-10-16(13-2-1-6-24-19(13)26-17)25-12-5-7-23-18(21)9-12/h1-10H,(H,23,24,25,26)
InChIKeyJOWDWCGCNXGGEV-UHFFFAOYSA-N
MW385.23 g/mol
LogP5.88
Rot. Bonds3

About 2-(5-chloro-2-fluorophenyl)-N-(2-chloro-4-pyridinyl)-1,8-naphthyridin-4-amine

2-(5-chloro-2-fluorophenyl)-N-(2-chloro-4-pyridinyl)-1,8-naphthyridin-4-amine (PubChem CID 88913140) has the molecular formula C19H11Cl2FN4 and a molecular weight of 385.23 g/mol. Its IUPAC name is 2-(5-chloro-2-fluorophenyl)-N-(2-chloro-4-pyridinyl)-1,8-naphthyridin-4-amine.

Molecular Properties

Compound Name2-(5-chloro-2-fluorophenyl)-N-(2-chloro-4-pyridinyl)-1,8-naphthyridin-4-amine
PubChem CID88913140
Molecular FormulaC19H11Cl2FN4
Molecular Weight385.23 g/mol
Exact Mass384.03
IUPAC Name2-(5-chloro-2-fluorophenyl)-N-(2-chloro-4-pyridinyl)-1,8-naphthyridin-4-amine
SMILESFc1ccc(Cl)cc1-c1cc(Nc2ccnc(Cl)c2)c2cccnc2n1
InChIInChI=1S/C19H11Cl2FN4/c20-11-3-4-15(22)14(8-11)17-10-16(13-2-1-6-24-19(13)26-17)25-12-5-7-23-18(21)9-12/h1-10H,(H,23,24,25,26)
InChIKeyJOWDWCGCNXGGEV-UHFFFAOYSA-N
XLogP5.88
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500385.23
LogP ≤ 55.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(5-chloro-2-fluorophenyl)-N-(2-chloro-4-pyridinyl)-1,8-naphthyridin-4-amine?
The IUPAC name of 2-(5-chloro-2-fluorophenyl)-N-(2-chloro-4-pyridinyl)-1,8-naphthyridin-4-amine (CID 88913140) is 2-(5-chloro-2-fluorophenyl)-N-(2-chloro-4-pyridinyl)-1,8-naphthyridin-4-amine.
What is the SMILES notation for 2-(5-chloro-2-fluorophenyl)-N-(2-chloro-4-pyridinyl)-1,8-naphthyridin-4-amine?
The canonical SMILES for 2-(5-chloro-2-fluorophenyl)-N-(2-chloro-4-pyridinyl)-1,8-naphthyridin-4-amine is Fc1ccc(Cl)cc1-c1cc(Nc2ccnc(Cl)c2)c2cccnc2n1.
What is the InChIKey of 2-(5-chloro-2-fluorophenyl)-N-(2-chloro-4-pyridinyl)-1,8-naphthyridin-4-amine?
The InChIKey is JOWDWCGCNXGGEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H11Cl2FN4/c20-11-3-4-15(22)14(8-11)17-10-16(13-2-1-6-24-19(13)26-17)25-12-5-7-23-18(21)9-12/h1-10H,(H,23,24,25,26).
What are the key properties of 2-(5-chloro-2-fluorophenyl)-N-(2-chloro-4-pyridinyl)-1,8-naphthyridin-4-amine?
2-(5-chloro-2-fluorophenyl)-N-(2-chloro-4-pyridinyl)-1,8-naphthyridin-4-amine has a molecular weight of 385.23 g/mol, XLogP of 5.88, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chloro-2-fluorophenyl)-N-(2-chloro-4-pyridinyl)-1,8-naphthyridin-4-amine is sourced from PubChem (CID 88913140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).