7-bromo-N-methylnaphthalene-1-carboxamide

C12H10BrNO — CID 178046455

IUPAC7-bromo-N-methylnaphthalene-1-carboxamide
SMILESCNC(=O)c1cccc2ccc(Br)cc12
InChIInChI=1S/C12H10BrNO/c1-14-12(15)10-4-2-3-8-5-6-9(13)7-11(8)10/h2-7H,1H3,(H,14,15)
InChIKeyUAZGPTVQCJSXRM-UHFFFAOYSA-N
MW264.12 g/mol
LogP2.96
Rot. Bonds1

About 7-bromo-N-methylnaphthalene-1-carboxamide

7-bromo-N-methylnaphthalene-1-carboxamide (PubChem CID 178046455) has the molecular formula C12H10BrNO and a molecular weight of 264.12 g/mol. Its IUPAC name is 7-bromo-N-methylnaphthalene-1-carboxamide.

Molecular Properties

Compound Name7-bromo-N-methylnaphthalene-1-carboxamide
PubChem CID178046455
Molecular FormulaC12H10BrNO
Molecular Weight264.12 g/mol
Exact Mass262.99
IUPAC Name7-bromo-N-methylnaphthalene-1-carboxamide
SMILESCNC(=O)c1cccc2ccc(Br)cc12
InChIInChI=1S/C12H10BrNO/c1-14-12(15)10-4-2-3-8-5-6-9(13)7-11(8)10/h2-7H,1H3,(H,14,15)
InChIKeyUAZGPTVQCJSXRM-UHFFFAOYSA-N
XLogP2.96
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.12
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

7-bromonaphthalene-1-carboxylate;thallium(1+)
CID 22604889
2,4-dibromo-N-methylbenzamide
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5-bromo-N-methyl-1H-indole-3-carboxamide
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5-bromo-N-methyl-2-(methylamino)benzamide
CID 130751837
5-bromo-2-(naphthalene-1-carbonylamino)benzoic acid
CID 10090515
5-(methylcarbamoyl)naphthalene-2-sulfonic acid
CID 163232980
1-(7-bromonaphthalen-1-yl)ethanone;methane;1-(7-pyrimidin-5-ylnaphthalen-1-yl)ethanone
CID 158504218
4-bromo-N-methyl-2-propan-2-ylbenzamide
CID 146035002
N-methyl-2-naphthalen-1-ylsulfanylbenzamide
CID 2801926
N-[2-[(3-bromobenzoyl)amino]ethyl]naphthalene-1-carboxamide
CID 108539666
2-bromo-3-chloro-N-methylbenzamide
CID 69377341

Frequently Asked Questions

What is the IUPAC name of 7-bromo-N-methylnaphthalene-1-carboxamide?
The IUPAC name of 7-bromo-N-methylnaphthalene-1-carboxamide (CID 178046455) is 7-bromo-N-methylnaphthalene-1-carboxamide.
What is the SMILES notation for 7-bromo-N-methylnaphthalene-1-carboxamide?
The canonical SMILES for 7-bromo-N-methylnaphthalene-1-carboxamide is CNC(=O)c1cccc2ccc(Br)cc12.
What is the InChIKey of 7-bromo-N-methylnaphthalene-1-carboxamide?
The InChIKey is UAZGPTVQCJSXRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10BrNO/c1-14-12(15)10-4-2-3-8-5-6-9(13)7-11(8)10/h2-7H,1H3,(H,14,15).
What are the key properties of 7-bromo-N-methylnaphthalene-1-carboxamide?
7-bromo-N-methylnaphthalene-1-carboxamide has a molecular weight of 264.12 g/mol, XLogP of 2.96, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-N-methylnaphthalene-1-carboxamide is sourced from PubChem (CID 178046455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).