2-bromo-5-methoxy-N-(6-methoxy-3-pyridinyl)benzamide

C14H13BrN2O3 — CID 27645934

IUPAC2-bromo-5-methoxy-N-(6-methoxy-3-pyridinyl)benzamide
SMILESCOc1ccc(Br)c(C(=O)Nc2ccc(OC)nc2)c1
InChIInChI=1S/C14H13BrN2O3/c1-19-10-4-5-12(15)11(7-10)14(18)17-9-3-6-13(20-2)16-8-9/h3-8H,1-2H3,(H,17,18)
InChIKeyQEOSAEWJNGOGOE-UHFFFAOYSA-N
MW337.17 g/mol
LogP3.11
Rot. Bonds4

About 2-bromo-5-methoxy-N-(6-methoxy-3-pyridinyl)benzamide

2-bromo-5-methoxy-N-(6-methoxy-3-pyridinyl)benzamide (PubChem CID 27645934) has the molecular formula C14H13BrN2O3 and a molecular weight of 337.17 g/mol. Its IUPAC name is 2-bromo-5-methoxy-N-(6-methoxy-3-pyridinyl)benzamide.

Molecular Properties

Compound Name2-bromo-5-methoxy-N-(6-methoxy-3-pyridinyl)benzamide
PubChem CID27645934
Molecular FormulaC14H13BrN2O3
Molecular Weight337.17 g/mol
Exact Mass336.01
IUPAC Name2-bromo-5-methoxy-N-(6-methoxy-3-pyridinyl)benzamide
SMILESCOc1ccc(Br)c(C(=O)Nc2ccc(OC)nc2)c1
InChIInChI=1S/C14H13BrN2O3/c1-19-10-4-5-12(15)11(7-10)14(18)17-9-3-6-13(20-2)16-8-9/h3-8H,1-2H3,(H,17,18)
InChIKeyQEOSAEWJNGOGOE-UHFFFAOYSA-N
XLogP3.11
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.17
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-bromo-N-[2-(dimethylamino)pyrimidin-5-yl]-5-methoxybenzamide
CID 122298027
2-bromo-5-methoxy-N-pyrimidin-5-ylbenzamide
CID 104856860
4-bromo-3-fluoro-N-(6-methoxy-3-pyridinyl)benzamide
CID 47421902
2-bromo-5-methoxy-N-(4-propan-2-yloxyphenyl)benzamide
CID 55749089
2-bromo-N-(5-fluoro-2-pyridinyl)-5-methoxybenzamide
CID 62877597
2-bromo-N-[4-(cyanomethoxy)phenyl]-5-methoxybenzamide
CID 30873503
2-bromo-N-[4-[(4-ethoxyphenyl)carbamoyl]phenyl]-5-methoxybenzamide
CID 112789539
2-bromo-5-methoxy-N-[4-(propan-2-ylcarbamoyl)phenyl]benzamide
CID 55865424
2-bromo-N-[4-(cyclopropanecarbonylamino)phenyl]-5-methoxybenzamide
CID 42470780
2-bromo-N-(3-fluoro-4-hydroxyphenyl)-5-methoxybenzamide
CID 64781077
5-amino-N-(6-methoxy-3-pyridinyl)-2,4-dimethylbenzamide
CID 102704818
2-bromo-N-(3-hydroxyphenyl)-5-methoxybenzamide
CID 28739934

Frequently Asked Questions

What is the IUPAC name of 2-bromo-5-methoxy-N-(6-methoxy-3-pyridinyl)benzamide?
The IUPAC name of 2-bromo-5-methoxy-N-(6-methoxy-3-pyridinyl)benzamide (CID 27645934) is 2-bromo-5-methoxy-N-(6-methoxy-3-pyridinyl)benzamide.
What is the SMILES notation for 2-bromo-5-methoxy-N-(6-methoxy-3-pyridinyl)benzamide?
The canonical SMILES for 2-bromo-5-methoxy-N-(6-methoxy-3-pyridinyl)benzamide is COc1ccc(Br)c(C(=O)Nc2ccc(OC)nc2)c1.
What is the InChIKey of 2-bromo-5-methoxy-N-(6-methoxy-3-pyridinyl)benzamide?
The InChIKey is QEOSAEWJNGOGOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13BrN2O3/c1-19-10-4-5-12(15)11(7-10)14(18)17-9-3-6-13(20-2)16-8-9/h3-8H,1-2H3,(H,17,18).
What are the key properties of 2-bromo-5-methoxy-N-(6-methoxy-3-pyridinyl)benzamide?
2-bromo-5-methoxy-N-(6-methoxy-3-pyridinyl)benzamide has a molecular weight of 337.17 g/mol, XLogP of 3.11, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-5-methoxy-N-(6-methoxy-3-pyridinyl)benzamide is sourced from PubChem (CID 27645934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).