[3-[[5-(methoxymethyl)-1,2-oxazol-3-yl]methoxy]-6-methyl-2-pyridinyl]methanamine

C13H17N3O3 — CID 79150560

IUPAC[3-[[5-(methoxymethyl)-1,2-oxazol-3-yl]methoxy]-6-methyl-2-pyridinyl]methanamine
SMILESCOCc1cc(COc2ccc(C)nc2CN)no1
InChIInChI=1S/C13H17N3O3/c1-9-3-4-13(12(6-14)15-9)18-7-10-5-11(8-17-2)19-16-10/h3-5H,6-8,14H2,1-2H3
InChIKeyHSHSOWFVBVXCPD-UHFFFAOYSA-N
MW263.30 g/mol
LogP1.56
Rot. Bonds6

About [3-[[5-(methoxymethyl)-1,2-oxazol-3-yl]methoxy]-6-methyl-2-pyridinyl]methanamine

[3-[[5-(methoxymethyl)-1,2-oxazol-3-yl]methoxy]-6-methyl-2-pyridinyl]methanamine (PubChem CID 79150560) has the molecular formula C13H17N3O3 and a molecular weight of 263.30 g/mol. Its IUPAC name is [3-[[5-(methoxymethyl)-1,2-oxazol-3-yl]methoxy]-6-methyl-2-pyridinyl]methanamine.

Molecular Properties

Compound Name[3-[[5-(methoxymethyl)-1,2-oxazol-3-yl]methoxy]-6-methyl-2-pyridinyl]methanamine
PubChem CID79150560
Molecular FormulaC13H17N3O3
Molecular Weight263.30 g/mol
Exact Mass263.13
IUPAC Name[3-[[5-(methoxymethyl)-1,2-oxazol-3-yl]methoxy]-6-methyl-2-pyridinyl]methanamine
SMILESCOCc1cc(COc2ccc(C)nc2CN)no1
InChIInChI=1S/C13H17N3O3/c1-9-3-4-13(12(6-14)15-9)18-7-10-5-11(8-17-2)19-16-10/h3-5H,6-8,14H2,1-2H3
InChIKeyHSHSOWFVBVXCPD-UHFFFAOYSA-N
XLogP1.56
TPSA83.40 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.30
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [3-[[5-(methoxymethyl)-1,2-oxazol-3-yl]methoxy]-6-methyl-2-pyridinyl]methanamine?
The IUPAC name of [3-[[5-(methoxymethyl)-1,2-oxazol-3-yl]methoxy]-6-methyl-2-pyridinyl]methanamine (CID 79150560) is [3-[[5-(methoxymethyl)-1,2-oxazol-3-yl]methoxy]-6-methyl-2-pyridinyl]methanamine.
What is the SMILES notation for [3-[[5-(methoxymethyl)-1,2-oxazol-3-yl]methoxy]-6-methyl-2-pyridinyl]methanamine?
The canonical SMILES for [3-[[5-(methoxymethyl)-1,2-oxazol-3-yl]methoxy]-6-methyl-2-pyridinyl]methanamine is COCc1cc(COc2ccc(C)nc2CN)no1.
What is the InChIKey of [3-[[5-(methoxymethyl)-1,2-oxazol-3-yl]methoxy]-6-methyl-2-pyridinyl]methanamine?
The InChIKey is HSHSOWFVBVXCPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O3/c1-9-3-4-13(12(6-14)15-9)18-7-10-5-11(8-17-2)19-16-10/h3-5H,6-8,14H2,1-2H3.
What are the key properties of [3-[[5-(methoxymethyl)-1,2-oxazol-3-yl]methoxy]-6-methyl-2-pyridinyl]methanamine?
[3-[[5-(methoxymethyl)-1,2-oxazol-3-yl]methoxy]-6-methyl-2-pyridinyl]methanamine has a molecular weight of 263.30 g/mol, XLogP of 1.56, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[[5-(methoxymethyl)-1,2-oxazol-3-yl]methoxy]-6-methyl-2-pyridinyl]methanamine is sourced from PubChem (CID 79150560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).