(2,5-dibromophenyl)-naphthalen-1-ylmethanamine

C17H13Br2N — CID 43108974

IUPAC(2,5-dibromophenyl)-naphthalen-1-ylmethanamine
SMILESNC(c1cc(Br)ccc1Br)c1cccc2ccccc12
InChIInChI=1S/C17H13Br2N/c18-12-8-9-16(19)15(10-12)17(20)14-7-3-5-11-4-1-2-6-13(11)14/h1-10,17H,20H2
InChIKeyNSQXVLDTVVMIAH-UHFFFAOYSA-N
MW391.11 g/mol
LogP5.41
Rot. Bonds2

About (2,5-dibromophenyl)-naphthalen-1-ylmethanamine

(2,5-dibromophenyl)-naphthalen-1-ylmethanamine (PubChem CID 43108974) has the molecular formula C17H13Br2N and a molecular weight of 391.11 g/mol. Its IUPAC name is (2,5-dibromophenyl)-naphthalen-1-ylmethanamine.

Molecular Properties

Compound Name(2,5-dibromophenyl)-naphthalen-1-ylmethanamine
PubChem CID43108974
Molecular FormulaC17H13Br2N
Molecular Weight391.11 g/mol
Exact Mass388.94
IUPAC Name(2,5-dibromophenyl)-naphthalen-1-ylmethanamine
SMILESNC(c1cc(Br)ccc1Br)c1cccc2ccccc12
InChIInChI=1S/C17H13Br2N/c18-12-8-9-16(19)15(10-12)17(20)14-7-3-5-11-4-1-2-6-13(11)14/h1-10,17H,20H2
InChIKeyNSQXVLDTVVMIAH-UHFFFAOYSA-N
XLogP5.41
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500391.11
LogP ≤ 55.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze (2,5-dibromophenyl)-naphthalen-1-ylmethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2-bromo-5-methoxyphenyl)-naphthalen-1-ylmethanamine
CID 105141322
1-[2-bromo-2-(2,5-dibromophenyl)ethyl]naphthalene
CID 114375566
(2-bromo-5-methylphenyl)-(2,5-dibromophenyl)methanamine
CID 81110281
naphthalen-1-yl-(2,4,5-trimethylphenyl)methanamine
CID 64990309
(4-bromo-2-fluorophenyl)-(4-bromonaphthalen-1-yl)methanamine
CID 79589918
2-(3-bromophenyl)-1-naphthalen-1-ylethanamine
CID 63412102
2,5-dibromo-N-(1-naphthalen-1-ylethyl)aniline
CID 43736721
[(5-bromo-2-methylphenyl)-naphthalen-1-ylmethyl]hydrazine
CID 105301219
4-[amino(naphthalen-1-yl)methyl]aniline
CID 116936837
(2,5-dibromophenyl)-quinolin-3-ylmethanamine
CID 115798842
1-[bis(5-bromo-2-methoxyphenyl)methyl]naphthalene
CID 156583433
(5-bromo-2-fluorophenyl)-naphthalen-1-ylmethanol
CID 63894699

Frequently Asked Questions

What is the IUPAC name of (2,5-dibromophenyl)-naphthalen-1-ylmethanamine?
The IUPAC name of (2,5-dibromophenyl)-naphthalen-1-ylmethanamine (CID 43108974) is (2,5-dibromophenyl)-naphthalen-1-ylmethanamine.
What is the SMILES notation for (2,5-dibromophenyl)-naphthalen-1-ylmethanamine?
The canonical SMILES for (2,5-dibromophenyl)-naphthalen-1-ylmethanamine is NC(c1cc(Br)ccc1Br)c1cccc2ccccc12.
What is the InChIKey of (2,5-dibromophenyl)-naphthalen-1-ylmethanamine?
The InChIKey is NSQXVLDTVVMIAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13Br2N/c18-12-8-9-16(19)15(10-12)17(20)14-7-3-5-11-4-1-2-6-13(11)14/h1-10,17H,20H2.
What are the key properties of (2,5-dibromophenyl)-naphthalen-1-ylmethanamine?
(2,5-dibromophenyl)-naphthalen-1-ylmethanamine has a molecular weight of 391.11 g/mol, XLogP of 5.41, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-dibromophenyl)-naphthalen-1-ylmethanamine is sourced from PubChem (CID 43108974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).