6-(5-pyridin-4-yl-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide

C19H17N5O — CID 86305321

IUPAC6-(5-pyridin-4-yl-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
SMILESNC(=O)N1CCCc2cc(-c3cncc(-c4ccncc4)c3)cnc21
InChIInChI=1S/C19H17N5O/c20-19(25)24-7-1-2-14-8-17(12-23-18(14)24)16-9-15(10-22-11-16)13-3-5-21-6-4-13/h3-6,8-12H,1-2,7H2,(H2,20,25)
InChIKeyBEKLJAZGJWJSSX-UHFFFAOYSA-N
MW331.38 g/mol
LogP3.04
Rot. Bonds2

About 6-(5-pyridin-4-yl-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide

6-(5-pyridin-4-yl-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide (PubChem CID 86305321) has the molecular formula C19H17N5O and a molecular weight of 331.38 g/mol. Its IUPAC name is 6-(5-pyridin-4-yl-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide.

Molecular Properties

Compound Name6-(5-pyridin-4-yl-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
PubChem CID86305321
Molecular FormulaC19H17N5O
Molecular Weight331.38 g/mol
Exact Mass331.14
IUPAC Name6-(5-pyridin-4-yl-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
SMILESNC(=O)N1CCCc2cc(-c3cncc(-c4ccncc4)c3)cnc21
InChIInChI=1S/C19H17N5O/c20-19(25)24-7-1-2-14-8-17(12-23-18(14)24)16-9-15(10-22-11-16)13-3-5-21-6-4-13/h3-6,8-12H,1-2,7H2,(H2,20,25)
InChIKeyBEKLJAZGJWJSSX-UHFFFAOYSA-N
XLogP3.04
TPSA85.00 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.38
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(5-pyridin-4-yl-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
The IUPAC name of 6-(5-pyridin-4-yl-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide (CID 86305321) is 6-(5-pyridin-4-yl-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide.
What is the SMILES notation for 6-(5-pyridin-4-yl-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
The canonical SMILES for 6-(5-pyridin-4-yl-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide is NC(=O)N1CCCc2cc(-c3cncc(-c4ccncc4)c3)cnc21.
What is the InChIKey of 6-(5-pyridin-4-yl-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
The InChIKey is BEKLJAZGJWJSSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N5O/c20-19(25)24-7-1-2-14-8-17(12-23-18(14)24)16-9-15(10-22-11-16)13-3-5-21-6-4-13/h3-6,8-12H,1-2,7H2,(H2,20,25).
What are the key properties of 6-(5-pyridin-4-yl-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
6-(5-pyridin-4-yl-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide has a molecular weight of 331.38 g/mol, XLogP of 3.04, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-pyridin-4-yl-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide is sourced from PubChem (CID 86305321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).