3-bromo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridin-4-amine

C15H15BrN2 — CID 104777001

IUPAC3-bromo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridin-4-amine
SMILESBrc1cnccc1NC1CCc2ccccc2C1
InChIInChI=1S/C15H15BrN2/c16-14-10-17-8-7-15(14)18-13-6-5-11-3-1-2-4-12(11)9-13/h1-4,7-8,10,13H,5-6,9H2,(H,17,18)
InChIKeyVLJVDQODNYIJHW-UHFFFAOYSA-N
MW303.20 g/mol
LogP3.81
Rot. Bonds2

About 3-bromo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridin-4-amine

3-bromo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridin-4-amine (PubChem CID 104777001) has the molecular formula C15H15BrN2 and a molecular weight of 303.20 g/mol. Its IUPAC name is 3-bromo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridin-4-amine.

Molecular Properties

Compound Name3-bromo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridin-4-amine
PubChem CID104777001
Molecular FormulaC15H15BrN2
Molecular Weight303.20 g/mol
Exact Mass302.04
IUPAC Name3-bromo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridin-4-amine
SMILESBrc1cnccc1NC1CCc2ccccc2C1
InChIInChI=1S/C15H15BrN2/c16-14-10-17-8-7-15(14)18-13-6-5-11-3-1-2-4-12(11)9-13/h1-4,7-8,10,13H,5-6,9H2,(H,17,18)
InChIKeyVLJVDQODNYIJHW-UHFFFAOYSA-N
XLogP3.81
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.20
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1,2,3,4-tetrahydronaphthalen-2-yl)isoquinolin-5-amine
CID 43780496
N-(2,6-dibromophenyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 107597579
N-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]pyridin-2-amine
CID 94392451
3-bromo-N-(2-chloro-2,3-dihydro-1H-inden-1-yl)pyridin-4-amine
CID 114983465
N-(6-bromo-1,2,3,4-tetrahydronaphthalen-2-yl)-4-methylpyridin-3-amine
CID 63626601
4-bromo-5-fluoro-2-N-(1,2,3,4-tetrahydronaphthalen-2-yl)benzene-1,2-diamine
CID 116735834
3-bromo-N-(3,3-difluorocyclobutyl)pyridin-4-amine
CID 130719191
3-bromo-N-(4-propylcyclohexyl)pyridin-4-amine
CID 104776939
N-(1,2,3,4-tetrahydronaphthalen-2-yl)quinolin-5-amine
CID 43759315
N-(7-bicyclo[4.1.0]heptanyl)-3-bromopyridin-4-amine
CID 130909438
(2R)-N-(2-methoxyphenyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 31196228
2-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazine-2,6-diamine
CID 78988868

Frequently Asked Questions

What is the IUPAC name of 3-bromo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridin-4-amine?
The IUPAC name of 3-bromo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridin-4-amine (CID 104777001) is 3-bromo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridin-4-amine.
What is the SMILES notation for 3-bromo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridin-4-amine?
The canonical SMILES for 3-bromo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridin-4-amine is Brc1cnccc1NC1CCc2ccccc2C1.
What is the InChIKey of 3-bromo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridin-4-amine?
The InChIKey is VLJVDQODNYIJHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15BrN2/c16-14-10-17-8-7-15(14)18-13-6-5-11-3-1-2-4-12(11)9-13/h1-4,7-8,10,13H,5-6,9H2,(H,17,18).
What are the key properties of 3-bromo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridin-4-amine?
3-bromo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridin-4-amine has a molecular weight of 303.20 g/mol, XLogP of 3.81, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridin-4-amine is sourced from PubChem (CID 104777001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).