5-bromo-N-(6-methoxynaphthalen-2-yl)pyridin-2-amine

C16H13BrN2O — CID 115146533

IUPAC5-bromo-N-(6-methoxynaphthalen-2-yl)pyridin-2-amine
SMILESCOc1ccc2cc(Nc3ccc(Br)cn3)ccc2c1
InChIInChI=1S/C16H13BrN2O/c1-20-15-6-3-11-8-14(5-2-12(11)9-15)19-16-7-4-13(17)10-18-16/h2-10H,1H3,(H,18,19)
InChIKeyZNPGHMIYTLSBOI-UHFFFAOYSA-N
MW329.20 g/mol
LogP4.75
Rot. Bonds3

About 5-bromo-N-(6-methoxynaphthalen-2-yl)pyridin-2-amine

5-bromo-N-(6-methoxynaphthalen-2-yl)pyridin-2-amine (PubChem CID 115146533) has the molecular formula C16H13BrN2O and a molecular weight of 329.20 g/mol. Its IUPAC name is 5-bromo-N-(6-methoxynaphthalen-2-yl)pyridin-2-amine.

Molecular Properties

Compound Name5-bromo-N-(6-methoxynaphthalen-2-yl)pyridin-2-amine
PubChem CID115146533
Molecular FormulaC16H13BrN2O
Molecular Weight329.20 g/mol
Exact Mass328.02
IUPAC Name5-bromo-N-(6-methoxynaphthalen-2-yl)pyridin-2-amine
SMILESCOc1ccc2cc(Nc3ccc(Br)cn3)ccc2c1
InChIInChI=1S/C16H13BrN2O/c1-20-15-6-3-11-8-14(5-2-12(11)9-15)19-16-7-4-13(17)10-18-16/h2-10H,1H3,(H,18,19)
InChIKeyZNPGHMIYTLSBOI-UHFFFAOYSA-N
XLogP4.75
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.20
LogP ≤ 54.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-N-(6-bromonaphthalen-2-yl)pyridin-2-amine
CID 81260199
N-(5-bromo-2-pyridinyl)isoquinolin-6-amine
CID 134194515
5-bromo-N-(3-ethyl-4-methoxyphenyl)pyridin-2-amine
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5-bromo-N-(3,4,5-trimethoxyphenyl)pyridin-2-amine
CID 61374133
5-bromo-N-[4-(difluoromethoxy)phenyl]pyridin-2-amine
CID 61373209
5-bromo-N-(3-bromophenyl)pyridin-2-amine
CID 61375271
N-(5-bromo-2-pyridinyl)-2-(5-methoxyindol-1-yl)acetamide
CID 29139061
3-bromo-N-[6-(4-methoxyanilino)-3-pyridinyl]benzamide
CID 113019497
N-(5-bromo-2-pyridinyl)-2,4-dimethoxybenzenesulfonamide
CID 19683207
4-N-(5-bromo-2-pyridinyl)-6-N-(3-methoxyphenyl)-5-nitropyrimidine-4,6-diamine
CID 23482445
5-bromo-N-[2-(4-methoxyphenoxy)propyl]pyridin-2-amine
CID 133323967
3-bromo-N-[6-(3-methoxyanilino)-3-pyridinyl]benzamide
CID 113019395

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(6-methoxynaphthalen-2-yl)pyridin-2-amine?
The IUPAC name of 5-bromo-N-(6-methoxynaphthalen-2-yl)pyridin-2-amine (CID 115146533) is 5-bromo-N-(6-methoxynaphthalen-2-yl)pyridin-2-amine.
What is the SMILES notation for 5-bromo-N-(6-methoxynaphthalen-2-yl)pyridin-2-amine?
The canonical SMILES for 5-bromo-N-(6-methoxynaphthalen-2-yl)pyridin-2-amine is COc1ccc2cc(Nc3ccc(Br)cn3)ccc2c1.
What is the InChIKey of 5-bromo-N-(6-methoxynaphthalen-2-yl)pyridin-2-amine?
The InChIKey is ZNPGHMIYTLSBOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13BrN2O/c1-20-15-6-3-11-8-14(5-2-12(11)9-15)19-16-7-4-13(17)10-18-16/h2-10H,1H3,(H,18,19).
What are the key properties of 5-bromo-N-(6-methoxynaphthalen-2-yl)pyridin-2-amine?
5-bromo-N-(6-methoxynaphthalen-2-yl)pyridin-2-amine has a molecular weight of 329.20 g/mol, XLogP of 4.75, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(6-methoxynaphthalen-2-yl)pyridin-2-amine is sourced from PubChem (CID 115146533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).