(7-bromo-3,4-dihydronaphthalen-2-yl)methanamine

C11H12BrN — CID 83842648

IUPAC(7-bromo-3,4-dihydronaphthalen-2-yl)methanamine
SMILESNCC1=Cc2cc(Br)ccc2CC1
InChIInChI=1S/C11H12BrN/c12-11-4-3-9-2-1-8(7-13)5-10(9)6-11/h3-6H,1-2,7,13H2
InChIKeyGMJPEVURXIPTQL-UHFFFAOYSA-N
MW238.13 g/mol
LogP2.74
Rot. Bonds1

About (7-bromo-3,4-dihydronaphthalen-2-yl)methanamine

(7-bromo-3,4-dihydronaphthalen-2-yl)methanamine (PubChem CID 83842648) has the molecular formula C11H12BrN and a molecular weight of 238.13 g/mol. Its IUPAC name is (7-bromo-3,4-dihydronaphthalen-2-yl)methanamine.

Molecular Properties

Compound Name(7-bromo-3,4-dihydronaphthalen-2-yl)methanamine
PubChem CID83842648
Molecular FormulaC11H12BrN
Molecular Weight238.13 g/mol
Exact Mass237.02
IUPAC Name(7-bromo-3,4-dihydronaphthalen-2-yl)methanamine
SMILESNCC1=Cc2cc(Br)ccc2CC1
InChIInChI=1S/C11H12BrN/c12-11-4-3-9-2-1-8(7-13)5-10(9)6-11/h3-6H,1-2,7,13H2
InChIKeyGMJPEVURXIPTQL-UHFFFAOYSA-N
XLogP2.74
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.13
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(3-bromo-8,9-dihydro-7H-benzo[7]annulen-6-yl)methanol
CID 71061309
6-bromo-3-(4-chlorophenyl)-1,2-dihydronaphthalene
CID 167038414
3-bromobicyclo[4.2.0]octa-1(6),2,4-triene
CID 10866980
(6-bromo-1-methyl-2,3-dihydroinden-1-yl)methanamine
CID 84728033
2-(7-bromo-3,4-dihydronaphthalen-2-yl)-4-iodo-1,3-thiazole
CID 144638037
6-[(4-bromophenyl)methyl]-7,8-dihydronaphthalen-2-ol
CID 91289776
1-(7-chloro-3,4-dihydronaphthalen-2-yl)-N-methylmethanamine
CID 105461387
(6-bromospiro[3,4-dihydro-2H-naphthalene-1,1'-cyclobutane]-2-yl)methanamine
CID 115057341
1-(aminomethyl)-6-bromo-3,4-dihydro-2H-naphthalen-1-ol
CID 83913110
5-bromo-1H-indene
CID 2747571
(6-bromo-3,4-dihydronaphthalen-1-yl)methanamine;hydrochloride
CID 175934245
2-(6-bromo-2,3-dihydroindol-1-yl)ethanamine
CID 22612698

Frequently Asked Questions

What is the IUPAC name of (7-bromo-3,4-dihydronaphthalen-2-yl)methanamine?
The IUPAC name of (7-bromo-3,4-dihydronaphthalen-2-yl)methanamine (CID 83842648) is (7-bromo-3,4-dihydronaphthalen-2-yl)methanamine.
What is the SMILES notation for (7-bromo-3,4-dihydronaphthalen-2-yl)methanamine?
The canonical SMILES for (7-bromo-3,4-dihydronaphthalen-2-yl)methanamine is NCC1=Cc2cc(Br)ccc2CC1.
What is the InChIKey of (7-bromo-3,4-dihydronaphthalen-2-yl)methanamine?
The InChIKey is GMJPEVURXIPTQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12BrN/c12-11-4-3-9-2-1-8(7-13)5-10(9)6-11/h3-6H,1-2,7,13H2.
What are the key properties of (7-bromo-3,4-dihydronaphthalen-2-yl)methanamine?
(7-bromo-3,4-dihydronaphthalen-2-yl)methanamine has a molecular weight of 238.13 g/mol, XLogP of 2.74, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (7-bromo-3,4-dihydronaphthalen-2-yl)methanamine is sourced from PubChem (CID 83842648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).