(2,4-dibromophenyl)-(3-ethylphenyl)methanamine

C15H15Br2N — CID 107946458

IUPAC(2,4-dibromophenyl)-(3-ethylphenyl)methanamine
SMILESCCc1cccc(C(N)c2ccc(Br)cc2Br)c1
InChIInChI=1S/C15H15Br2N/c1-2-10-4-3-5-11(8-10)15(18)13-7-6-12(16)9-14(13)17/h3-9,15H,2,18H2,1H3
InChIKeyGZNSLRMJRRSVSK-UHFFFAOYSA-N
MW369.10 g/mol
LogP4.82
Rot. Bonds3

About (2,4-dibromophenyl)-(3-ethylphenyl)methanamine

(2,4-dibromophenyl)-(3-ethylphenyl)methanamine (PubChem CID 107946458) has the molecular formula C15H15Br2N and a molecular weight of 369.10 g/mol. Its IUPAC name is (2,4-dibromophenyl)-(3-ethylphenyl)methanamine.

Molecular Properties

Compound Name(2,4-dibromophenyl)-(3-ethylphenyl)methanamine
PubChem CID107946458
Molecular FormulaC15H15Br2N
Molecular Weight369.10 g/mol
Exact Mass366.96
IUPAC Name(2,4-dibromophenyl)-(3-ethylphenyl)methanamine
SMILESCCc1cccc(C(N)c2ccc(Br)cc2Br)c1
InChIInChI=1S/C15H15Br2N/c1-2-10-4-3-5-11(8-10)15(18)13-7-6-12(16)9-14(13)17/h3-9,15H,2,18H2,1H3
InChIKeyGZNSLRMJRRSVSK-UHFFFAOYSA-N
XLogP4.82
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.10
LogP ≤ 54.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2,4-dibromophenyl)-(3-ethylphenyl)methanamine?
The IUPAC name of (2,4-dibromophenyl)-(3-ethylphenyl)methanamine (CID 107946458) is (2,4-dibromophenyl)-(3-ethylphenyl)methanamine.
What is the SMILES notation for (2,4-dibromophenyl)-(3-ethylphenyl)methanamine?
The canonical SMILES for (2,4-dibromophenyl)-(3-ethylphenyl)methanamine is CCc1cccc(C(N)c2ccc(Br)cc2Br)c1.
What is the InChIKey of (2,4-dibromophenyl)-(3-ethylphenyl)methanamine?
The InChIKey is GZNSLRMJRRSVSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15Br2N/c1-2-10-4-3-5-11(8-10)15(18)13-7-6-12(16)9-14(13)17/h3-9,15H,2,18H2,1H3.
What are the key properties of (2,4-dibromophenyl)-(3-ethylphenyl)methanamine?
(2,4-dibromophenyl)-(3-ethylphenyl)methanamine has a molecular weight of 369.10 g/mol, XLogP of 4.82, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-dibromophenyl)-(3-ethylphenyl)methanamine is sourced from PubChem (CID 107946458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).