3-bromo-5-methyl-N-(naphthalen-1-ylmethyl)pyridin-2-amine

C17H15BrN2 — CID 105366894

IUPAC3-bromo-5-methyl-N-(naphthalen-1-ylmethyl)pyridin-2-amine
SMILESCc1cnc(NCc2cccc3ccccc23)c(Br)c1
InChIInChI=1S/C17H15BrN2/c1-12-9-16(18)17(19-10-12)20-11-14-7-4-6-13-5-2-3-8-15(13)14/h2-10H,11H2,1H3,(H,19,20)
InChIKeyNRJVUHMHLNVBPL-UHFFFAOYSA-N
MW327.23 g/mol
LogP4.92
Rot. Bonds3

About 3-bromo-5-methyl-N-(naphthalen-1-ylmethyl)pyridin-2-amine

3-bromo-5-methyl-N-(naphthalen-1-ylmethyl)pyridin-2-amine (PubChem CID 105366894) has the molecular formula C17H15BrN2 and a molecular weight of 327.23 g/mol. Its IUPAC name is 3-bromo-5-methyl-N-(naphthalen-1-ylmethyl)pyridin-2-amine.

Molecular Properties

Compound Name3-bromo-5-methyl-N-(naphthalen-1-ylmethyl)pyridin-2-amine
PubChem CID105366894
Molecular FormulaC17H15BrN2
Molecular Weight327.23 g/mol
Exact Mass326.04
IUPAC Name3-bromo-5-methyl-N-(naphthalen-1-ylmethyl)pyridin-2-amine
SMILESCc1cnc(NCc2cccc3ccccc23)c(Br)c1
InChIInChI=1S/C17H15BrN2/c1-12-9-16(18)17(19-10-12)20-11-14-7-4-6-13-5-2-3-8-15(13)14/h2-10H,11H2,1H3,(H,19,20)
InChIKeyNRJVUHMHLNVBPL-UHFFFAOYSA-N
XLogP4.92
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.23
LogP ≤ 54.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-bromo-N-[(2-bromophenyl)methyl]-5-methylpyridin-2-amine
CID 105366810
3-bromo-2-N-(naphthalen-1-ylmethyl)pyridine-2,5-diamine
CID 79535450
3-bromo-N-[[2-(ethoxymethyl)phenyl]methyl]-5-methylpyridin-2-amine
CID 105366749
3-bromo-5-methyl-N-naphthalen-1-ylpyridin-2-amine
CID 58028170
3-bromo-5-(difluoromethyl)-N-(isoquinolin-5-ylmethyl)pyridin-2-amine
CID 167827397
2-methyl-N-(naphthalen-1-ylmethyl)pyrimidin-4-amine
CID 55112812
3,5-dibromo-N-[(2-chlorophenyl)methyl]pyridin-2-amine
CID 12611962
3-bromo-5-methyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyridin-2-amine
CID 106402597
3-bromo-5-methyl-N-(2-phenoxyethyl)pyridin-2-amine
CID 105366850
3-bromo-N-[(3,4-difluorophenyl)methyl]-5-methylpyridin-2-amine
CID 105366846
6-hydrazinyl-5-methyl-N-(naphthalen-1-ylmethyl)pyrimidin-4-amine
CID 80902524
5-methyl-N-(naphthalen-1-ylmethyl)-1H-imidazol-2-amine
CID 106571383

Frequently Asked Questions

What is the IUPAC name of 3-bromo-5-methyl-N-(naphthalen-1-ylmethyl)pyridin-2-amine?
The IUPAC name of 3-bromo-5-methyl-N-(naphthalen-1-ylmethyl)pyridin-2-amine (CID 105366894) is 3-bromo-5-methyl-N-(naphthalen-1-ylmethyl)pyridin-2-amine.
What is the SMILES notation for 3-bromo-5-methyl-N-(naphthalen-1-ylmethyl)pyridin-2-amine?
The canonical SMILES for 3-bromo-5-methyl-N-(naphthalen-1-ylmethyl)pyridin-2-amine is Cc1cnc(NCc2cccc3ccccc23)c(Br)c1.
What is the InChIKey of 3-bromo-5-methyl-N-(naphthalen-1-ylmethyl)pyridin-2-amine?
The InChIKey is NRJVUHMHLNVBPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15BrN2/c1-12-9-16(18)17(19-10-12)20-11-14-7-4-6-13-5-2-3-8-15(13)14/h2-10H,11H2,1H3,(H,19,20).
What are the key properties of 3-bromo-5-methyl-N-(naphthalen-1-ylmethyl)pyridin-2-amine?
3-bromo-5-methyl-N-(naphthalen-1-ylmethyl)pyridin-2-amine has a molecular weight of 327.23 g/mol, XLogP of 4.92, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-5-methyl-N-(naphthalen-1-ylmethyl)pyridin-2-amine is sourced from PubChem (CID 105366894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).