6-bromo-N-(4-bromo-2-pyridinyl)naphthalene-2-carboxamide

C16H10Br2N2O — CID 102820628

IUPAC6-bromo-N-(4-bromo-2-pyridinyl)naphthalene-2-carboxamide
SMILESO=C(Nc1cc(Br)ccn1)c1ccc2cc(Br)ccc2c1
InChIInChI=1S/C16H10Br2N2O/c17-13-4-3-10-7-12(2-1-11(10)8-13)16(21)20-15-9-14(18)5-6-19-15/h1-9H,(H,19,20,21)
InChIKeyBMSDNDPNRJZYDH-UHFFFAOYSA-N
MW406.08 g/mol
LogP5.01
Rot. Bonds2

About 6-bromo-N-(4-bromo-2-pyridinyl)naphthalene-2-carboxamide

6-bromo-N-(4-bromo-2-pyridinyl)naphthalene-2-carboxamide (PubChem CID 102820628) has the molecular formula C16H10Br2N2O and a molecular weight of 406.08 g/mol. Its IUPAC name is 6-bromo-N-(4-bromo-2-pyridinyl)naphthalene-2-carboxamide.

Molecular Properties

Compound Name6-bromo-N-(4-bromo-2-pyridinyl)naphthalene-2-carboxamide
PubChem CID102820628
Molecular FormulaC16H10Br2N2O
Molecular Weight406.08 g/mol
Exact Mass403.92
IUPAC Name6-bromo-N-(4-bromo-2-pyridinyl)naphthalene-2-carboxamide
SMILESO=C(Nc1cc(Br)ccn1)c1ccc2cc(Br)ccc2c1
InChIInChI=1S/C16H10Br2N2O/c17-13-4-3-10-7-12(2-1-11(10)8-13)16(21)20-15-9-14(18)5-6-19-15/h1-9H,(H,19,20,21)
InChIKeyBMSDNDPNRJZYDH-UHFFFAOYSA-N
XLogP5.01
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500406.08
LogP ≤ 55.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-bromo-2-pyridinyl)-3,4-dimethoxybenzamide
CID 102674424
N-(4-bromo-2-pyridinyl)-4-hydroxy-3-methylbenzamide
CID 107674194
6-bromo-N-(6-oxo-1H-pyridazin-3-yl)naphthalene-2-carboxamide
CID 116787217
N-(4-bromo-2-pyridinyl)-3-fluorobenzamide
CID 3011458
N-(4-bromo-2-pyridinyl)-4-propan-2-ylbenzamide
CID 102674107
N-(4-bromo-2-pyridinyl)-4-nitrobenzamide
CID 102674414
N-(4-bromo-2-pyridinyl)-3,4,5-trimethoxybenzamide
CID 127109293
N-(4-bromo-2-pyridinyl)-3-chloro-5-methylbenzamide
CID 102674199
N-(4-bromo-2-pyridinyl)-5-methylpyrazine-2-carboxamide
CID 102674370
N-(4-bromo-2-pyridinyl)furan-2-carboxamide
CID 102674239
N-(4-bromo-2-pyridinyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide
CID 102674320
2-[(6-bromonaphthalen-2-yl)amino]pyridine-4-carboxylic acid
CID 81266781

Frequently Asked Questions

What is the IUPAC name of 6-bromo-N-(4-bromo-2-pyridinyl)naphthalene-2-carboxamide?
The IUPAC name of 6-bromo-N-(4-bromo-2-pyridinyl)naphthalene-2-carboxamide (CID 102820628) is 6-bromo-N-(4-bromo-2-pyridinyl)naphthalene-2-carboxamide.
What is the SMILES notation for 6-bromo-N-(4-bromo-2-pyridinyl)naphthalene-2-carboxamide?
The canonical SMILES for 6-bromo-N-(4-bromo-2-pyridinyl)naphthalene-2-carboxamide is O=C(Nc1cc(Br)ccn1)c1ccc2cc(Br)ccc2c1.
What is the InChIKey of 6-bromo-N-(4-bromo-2-pyridinyl)naphthalene-2-carboxamide?
The InChIKey is BMSDNDPNRJZYDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10Br2N2O/c17-13-4-3-10-7-12(2-1-11(10)8-13)16(21)20-15-9-14(18)5-6-19-15/h1-9H,(H,19,20,21).
What are the key properties of 6-bromo-N-(4-bromo-2-pyridinyl)naphthalene-2-carboxamide?
6-bromo-N-(4-bromo-2-pyridinyl)naphthalene-2-carboxamide has a molecular weight of 406.08 g/mol, XLogP of 5.01, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-N-(4-bromo-2-pyridinyl)naphthalene-2-carboxamide is sourced from PubChem (CID 102820628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).