6-pyrimidin-5-yl-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide

C13H13N5O — CID 86305618

IUPAC6-pyrimidin-5-yl-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
SMILESNC(=O)N1CCCc2cc(-c3cncnc3)cnc21
InChIInChI=1S/C13H13N5O/c14-13(19)18-3-1-2-9-4-10(7-17-12(9)18)11-5-15-8-16-6-11/h4-8H,1-3H2,(H2,14,19)
InChIKeyWTAZFNVBILHPDJ-UHFFFAOYSA-N
MW255.28 g/mol
LogP1.37
Rot. Bonds1

About 6-pyrimidin-5-yl-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide

6-pyrimidin-5-yl-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide (PubChem CID 86305618) has the molecular formula C13H13N5O and a molecular weight of 255.28 g/mol. Its IUPAC name is 6-pyrimidin-5-yl-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide.

Molecular Properties

Compound Name6-pyrimidin-5-yl-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
PubChem CID86305618
Molecular FormulaC13H13N5O
Molecular Weight255.28 g/mol
Exact Mass255.11
IUPAC Name6-pyrimidin-5-yl-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
SMILESNC(=O)N1CCCc2cc(-c3cncnc3)cnc21
InChIInChI=1S/C13H13N5O/c14-13(19)18-3-1-2-9-4-10(7-17-12(9)18)11-5-15-8-16-6-11/h4-8H,1-3H2,(H2,14,19)
InChIKeyWTAZFNVBILHPDJ-UHFFFAOYSA-N
XLogP1.37
TPSA85.00 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.28
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-pyrimidin-5-yl-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
The IUPAC name of 6-pyrimidin-5-yl-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide (CID 86305618) is 6-pyrimidin-5-yl-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide.
What is the SMILES notation for 6-pyrimidin-5-yl-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
The canonical SMILES for 6-pyrimidin-5-yl-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide is NC(=O)N1CCCc2cc(-c3cncnc3)cnc21.
What is the InChIKey of 6-pyrimidin-5-yl-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
The InChIKey is WTAZFNVBILHPDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N5O/c14-13(19)18-3-1-2-9-4-10(7-17-12(9)18)11-5-15-8-16-6-11/h4-8H,1-3H2,(H2,14,19).
What are the key properties of 6-pyrimidin-5-yl-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
6-pyrimidin-5-yl-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide has a molecular weight of 255.28 g/mol, XLogP of 1.37, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-pyrimidin-5-yl-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide is sourced from PubChem (CID 86305618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).