N-(6-methoxy-3-pyridinyl)-3-[(5-methyl-1,3-oxazol-2-yl)methylamino]benzamide

C18H18N4O3 — CID 84588254

IUPACN-(6-methoxy-3-pyridinyl)-3-[(5-methyl-1,3-oxazol-2-yl)methylamino]benzamide
SMILESCOc1ccc(NC(=O)c2cccc(NCc3ncc(C)o3)c2)cn1
InChIInChI=1S/C18H18N4O3/c1-12-9-20-17(25-12)11-19-14-5-3-4-13(8-14)18(23)22-15-6-7-16(24-2)21-10-15/h3-10,19H,11H2,1-2H3,(H,22,23)
InChIKeyZXVWKWVFQNXQNY-UHFFFAOYSA-N
MW338.37 g/mol
LogP3.25
Rot. Bonds6

About N-(6-methoxy-3-pyridinyl)-3-[(5-methyl-1,3-oxazol-2-yl)methylamino]benzamide

N-(6-methoxy-3-pyridinyl)-3-[(5-methyl-1,3-oxazol-2-yl)methylamino]benzamide (PubChem CID 84588254) has the molecular formula C18H18N4O3 and a molecular weight of 338.37 g/mol. Its IUPAC name is N-(6-methoxy-3-pyridinyl)-3-[(5-methyl-1,3-oxazol-2-yl)methylamino]benzamide.

Molecular Properties

Compound NameN-(6-methoxy-3-pyridinyl)-3-[(5-methyl-1,3-oxazol-2-yl)methylamino]benzamide
PubChem CID84588254
Molecular FormulaC18H18N4O3
Molecular Weight338.37 g/mol
Exact Mass338.14
IUPAC NameN-(6-methoxy-3-pyridinyl)-3-[(5-methyl-1,3-oxazol-2-yl)methylamino]benzamide
SMILESCOc1ccc(NC(=O)c2cccc(NCc3ncc(C)o3)c2)cn1
InChIInChI=1S/C18H18N4O3/c1-12-9-20-17(25-12)11-19-14-5-3-4-13(8-14)18(23)22-15-6-7-16(24-2)21-10-15/h3-10,19H,11H2,1-2H3,(H,22,23)
InChIKeyZXVWKWVFQNXQNY-UHFFFAOYSA-N
XLogP3.25
TPSA89.28 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.37
LogP ≤ 53.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(6-methoxy-3-pyridinyl)-3-[(5-methyl-1,3-oxazol-2-yl)methylamino]benzamide?
The IUPAC name of N-(6-methoxy-3-pyridinyl)-3-[(5-methyl-1,3-oxazol-2-yl)methylamino]benzamide (CID 84588254) is N-(6-methoxy-3-pyridinyl)-3-[(5-methyl-1,3-oxazol-2-yl)methylamino]benzamide.
What is the SMILES notation for N-(6-methoxy-3-pyridinyl)-3-[(5-methyl-1,3-oxazol-2-yl)methylamino]benzamide?
The canonical SMILES for N-(6-methoxy-3-pyridinyl)-3-[(5-methyl-1,3-oxazol-2-yl)methylamino]benzamide is COc1ccc(NC(=O)c2cccc(NCc3ncc(C)o3)c2)cn1.
What is the InChIKey of N-(6-methoxy-3-pyridinyl)-3-[(5-methyl-1,3-oxazol-2-yl)methylamino]benzamide?
The InChIKey is ZXVWKWVFQNXQNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O3/c1-12-9-20-17(25-12)11-19-14-5-3-4-13(8-14)18(23)22-15-6-7-16(24-2)21-10-15/h3-10,19H,11H2,1-2H3,(H,22,23).
What are the key properties of N-(6-methoxy-3-pyridinyl)-3-[(5-methyl-1,3-oxazol-2-yl)methylamino]benzamide?
N-(6-methoxy-3-pyridinyl)-3-[(5-methyl-1,3-oxazol-2-yl)methylamino]benzamide has a molecular weight of 338.37 g/mol, XLogP of 3.25, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methoxy-3-pyridinyl)-3-[(5-methyl-1,3-oxazol-2-yl)methylamino]benzamide is sourced from PubChem (CID 84588254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).