[1-(6-methoxy-1,5-naphthyridin-4-yl)azetidin-3-yl]methanamine

C13H16N4O — CID 66953692

IUPAC[1-(6-methoxy-1,5-naphthyridin-4-yl)azetidin-3-yl]methanamine
SMILESCOc1ccc2nccc(N3CC(CN)C3)c2n1
InChIInChI=1S/C13H16N4O/c1-18-12-3-2-10-13(16-12)11(4-5-15-10)17-7-9(6-14)8-17/h2-5,9H,6-8,14H2,1H3
InChIKeyYBWRYIVELUSCDL-UHFFFAOYSA-N
MW244.30 g/mol
LogP1.03
Rot. Bonds3

About [1-(6-methoxy-1,5-naphthyridin-4-yl)azetidin-3-yl]methanamine

[1-(6-methoxy-1,5-naphthyridin-4-yl)azetidin-3-yl]methanamine (PubChem CID 66953692) has the molecular formula C13H16N4O and a molecular weight of 244.30 g/mol. Its IUPAC name is [1-(6-methoxy-1,5-naphthyridin-4-yl)azetidin-3-yl]methanamine.

Molecular Properties

Compound Name[1-(6-methoxy-1,5-naphthyridin-4-yl)azetidin-3-yl]methanamine
PubChem CID66953692
Molecular FormulaC13H16N4O
Molecular Weight244.30 g/mol
Exact Mass244.13
IUPAC Name[1-(6-methoxy-1,5-naphthyridin-4-yl)azetidin-3-yl]methanamine
SMILESCOc1ccc2nccc(N3CC(CN)C3)c2n1
InChIInChI=1S/C13H16N4O/c1-18-12-3-2-10-13(16-12)11(4-5-15-10)17-7-9(6-14)8-17/h2-5,9H,6-8,14H2,1H3
InChIKeyYBWRYIVELUSCDL-UHFFFAOYSA-N
XLogP1.03
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.30
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [1-(6-methoxy-1,5-naphthyridin-4-yl)azetidin-3-yl]methanamine?
The IUPAC name of [1-(6-methoxy-1,5-naphthyridin-4-yl)azetidin-3-yl]methanamine (CID 66953692) is [1-(6-methoxy-1,5-naphthyridin-4-yl)azetidin-3-yl]methanamine.
What is the SMILES notation for [1-(6-methoxy-1,5-naphthyridin-4-yl)azetidin-3-yl]methanamine?
The canonical SMILES for [1-(6-methoxy-1,5-naphthyridin-4-yl)azetidin-3-yl]methanamine is COc1ccc2nccc(N3CC(CN)C3)c2n1.
What is the InChIKey of [1-(6-methoxy-1,5-naphthyridin-4-yl)azetidin-3-yl]methanamine?
The InChIKey is YBWRYIVELUSCDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O/c1-18-12-3-2-10-13(16-12)11(4-5-15-10)17-7-9(6-14)8-17/h2-5,9H,6-8,14H2,1H3.
What are the key properties of [1-(6-methoxy-1,5-naphthyridin-4-yl)azetidin-3-yl]methanamine?
[1-(6-methoxy-1,5-naphthyridin-4-yl)azetidin-3-yl]methanamine has a molecular weight of 244.30 g/mol, XLogP of 1.03, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(6-methoxy-1,5-naphthyridin-4-yl)azetidin-3-yl]methanamine is sourced from PubChem (CID 66953692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).