N-(4-fluorophenyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine-7-carboxamide

C18H15FN4O — CID 163350838

IUPACN-(4-fluorophenyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine-7-carboxamide
SMILESO=C(Nc1ccc(F)cc1)N1CCc2nc3ncccc3cc2C1
InChIInChI=1S/C18H15FN4O/c19-14-3-5-15(6-4-14)21-18(24)23-9-7-16-13(11-23)10-12-2-1-8-20-17(12)22-16/h1-6,8,10H,7,9,11H2,(H,21,24)
InChIKeyQLBFLYWRZQWWCM-UHFFFAOYSA-N
MW322.34 g/mol
LogP3.36
Rot. Bonds1

About N-(4-fluorophenyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine-7-carboxamide

N-(4-fluorophenyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine-7-carboxamide (PubChem CID 163350838) has the molecular formula C18H15FN4O and a molecular weight of 322.34 g/mol. Its IUPAC name is N-(4-fluorophenyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine-7-carboxamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine-7-carboxamide
PubChem CID163350838
Molecular FormulaC18H15FN4O
Molecular Weight322.34 g/mol
Exact Mass322.12
IUPAC NameN-(4-fluorophenyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine-7-carboxamide
SMILESO=C(Nc1ccc(F)cc1)N1CCc2nc3ncccc3cc2C1
InChIInChI=1S/C18H15FN4O/c19-14-3-5-15(6-4-14)21-18(24)23-9-7-16-13(11-23)10-12-2-1-8-20-17(12)22-16/h1-6,8,10H,7,9,11H2,(H,21,24)
InChIKeyQLBFLYWRZQWWCM-UHFFFAOYSA-N
XLogP3.36
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.34
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine-7-carboxamide?
The IUPAC name of N-(4-fluorophenyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine-7-carboxamide (CID 163350838) is N-(4-fluorophenyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine-7-carboxamide.
What is the SMILES notation for N-(4-fluorophenyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine-7-carboxamide?
The canonical SMILES for N-(4-fluorophenyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine-7-carboxamide is O=C(Nc1ccc(F)cc1)N1CCc2nc3ncccc3cc2C1.
What is the InChIKey of N-(4-fluorophenyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine-7-carboxamide?
The InChIKey is QLBFLYWRZQWWCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15FN4O/c19-14-3-5-15(6-4-14)21-18(24)23-9-7-16-13(11-23)10-12-2-1-8-20-17(12)22-16/h1-6,8,10H,7,9,11H2,(H,21,24).
What are the key properties of N-(4-fluorophenyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine-7-carboxamide?
N-(4-fluorophenyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine-7-carboxamide has a molecular weight of 322.34 g/mol, XLogP of 3.36, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine-7-carboxamide is sourced from PubChem (CID 163350838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).