2-(2-bromophenyl)-2-methylpropan-1-amine

C10H14BrN — CID 10489504

IUPAC2-(2-bromophenyl)-2-methylpropan-1-amine
SMILESCC(C)(CN)c1ccccc1Br
InChIInChI=1S/C10H14BrN/c1-10(2,7-12)8-5-3-4-6-9(8)11/h3-6H,7,12H2,1-2H3
InChIKeyVKIIPNMFKYLRKM-UHFFFAOYSA-N
MW228.13 g/mol
LogP2.69
Rot. Bonds2

About 2-(2-bromophenyl)-2-methylpropan-1-amine

2-(2-bromophenyl)-2-methylpropan-1-amine (PubChem CID 10489504) has the molecular formula C10H14BrN and a molecular weight of 228.13 g/mol. Its IUPAC name is 2-(2-bromophenyl)-2-methylpropan-1-amine.

Molecular Properties

Compound Name2-(2-bromophenyl)-2-methylpropan-1-amine
PubChem CID10489504
Molecular FormulaC10H14BrN
Molecular Weight228.13 g/mol
Exact Mass227.03
IUPAC Name2-(2-bromophenyl)-2-methylpropan-1-amine
SMILESCC(C)(CN)c1ccccc1Br
InChIInChI=1S/C10H14BrN/c1-10(2,7-12)8-5-3-4-6-9(8)11/h3-6H,7,12H2,1-2H3
InChIKeyVKIIPNMFKYLRKM-UHFFFAOYSA-N
XLogP2.69
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.13
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(2-bromophenyl)-2-methylpropan-1-amine?
The IUPAC name of 2-(2-bromophenyl)-2-methylpropan-1-amine (CID 10489504) is 2-(2-bromophenyl)-2-methylpropan-1-amine.
What is the SMILES notation for 2-(2-bromophenyl)-2-methylpropan-1-amine?
The canonical SMILES for 2-(2-bromophenyl)-2-methylpropan-1-amine is CC(C)(CN)c1ccccc1Br.
What is the InChIKey of 2-(2-bromophenyl)-2-methylpropan-1-amine?
The InChIKey is VKIIPNMFKYLRKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14BrN/c1-10(2,7-12)8-5-3-4-6-9(8)11/h3-6H,7,12H2,1-2H3.
What are the key properties of 2-(2-bromophenyl)-2-methylpropan-1-amine?
2-(2-bromophenyl)-2-methylpropan-1-amine has a molecular weight of 228.13 g/mol, XLogP of 2.69, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromophenyl)-2-methylpropan-1-amine is sourced from PubChem (CID 10489504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).