N-cyclobutyl-1,8-naphthyridine-2-carboxamide

C13H13N3O — CID 177046765

IUPACN-cyclobutyl-1,8-naphthyridine-2-carboxamide
SMILESO=C(NC1CCC1)c1ccc2cccnc2n1
InChIInChI=1S/C13H13N3O/c17-13(15-10-4-1-5-10)11-7-6-9-3-2-8-14-12(9)16-11/h2-3,6-8,10H,1,4-5H2,(H,15,17)
InChIKeyQNNWUVYIOSESQN-UHFFFAOYSA-N
MW227.27 g/mol
LogP1.91
Rot. Bonds2

About N-cyclobutyl-1,8-naphthyridine-2-carboxamide

N-cyclobutyl-1,8-naphthyridine-2-carboxamide (PubChem CID 177046765) has the molecular formula C13H13N3O and a molecular weight of 227.27 g/mol. Its IUPAC name is N-cyclobutyl-1,8-naphthyridine-2-carboxamide.

Molecular Properties

Compound NameN-cyclobutyl-1,8-naphthyridine-2-carboxamide
PubChem CID177046765
Molecular FormulaC13H13N3O
Molecular Weight227.27 g/mol
Exact Mass227.11
IUPAC NameN-cyclobutyl-1,8-naphthyridine-2-carboxamide
SMILESO=C(NC1CCC1)c1ccc2cccnc2n1
InChIInChI=1S/C13H13N3O/c17-13(15-10-4-1-5-10)11-7-6-9-3-2-8-14-12(9)16-11/h2-3,6-8,10H,1,4-5H2,(H,15,17)
InChIKeyQNNWUVYIOSESQN-UHFFFAOYSA-N
XLogP1.91
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.27
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclobutyl-1,8-naphthyridine-2-carboxamide?
The IUPAC name of N-cyclobutyl-1,8-naphthyridine-2-carboxamide (CID 177046765) is N-cyclobutyl-1,8-naphthyridine-2-carboxamide.
What is the SMILES notation for N-cyclobutyl-1,8-naphthyridine-2-carboxamide?
The canonical SMILES for N-cyclobutyl-1,8-naphthyridine-2-carboxamide is O=C(NC1CCC1)c1ccc2cccnc2n1.
What is the InChIKey of N-cyclobutyl-1,8-naphthyridine-2-carboxamide?
The InChIKey is QNNWUVYIOSESQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3O/c17-13(15-10-4-1-5-10)11-7-6-9-3-2-8-14-12(9)16-11/h2-3,6-8,10H,1,4-5H2,(H,15,17).
What are the key properties of N-cyclobutyl-1,8-naphthyridine-2-carboxamide?
N-cyclobutyl-1,8-naphthyridine-2-carboxamide has a molecular weight of 227.27 g/mol, XLogP of 1.91, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclobutyl-1,8-naphthyridine-2-carboxamide is sourced from PubChem (CID 177046765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).