2-(3,5-dichlorophenyl)propan-2-amine

C9H11Cl2N — CID 11195052

IUPAC2-(3,5-dichlorophenyl)propan-2-amine
SMILESCC(C)(N)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C9H11Cl2N/c1-9(2,12)6-3-7(10)5-8(11)4-6/h3-5H,12H2,1-2H3
InChIKeyAZEJGVWRTXUSHS-UHFFFAOYSA-N
MW204.10 g/mol
LogP3.19
Rot. Bonds1

About 2-(3,5-dichlorophenyl)propan-2-amine

2-(3,5-dichlorophenyl)propan-2-amine (PubChem CID 11195052) has the molecular formula C9H11Cl2N and a molecular weight of 204.10 g/mol. Its IUPAC name is 2-(3,5-dichlorophenyl)propan-2-amine.

Molecular Properties

Compound Name2-(3,5-dichlorophenyl)propan-2-amine
PubChem CID11195052
Molecular FormulaC9H11Cl2N
Molecular Weight204.10 g/mol
Exact Mass203.03
IUPAC Name2-(3,5-dichlorophenyl)propan-2-amine
SMILESCC(C)(N)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C9H11Cl2N/c1-9(2,12)6-3-7(10)5-8(11)4-6/h3-5H,12H2,1-2H3
InChIKeyAZEJGVWRTXUSHS-UHFFFAOYSA-N
XLogP3.19
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.10
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dichlorophenyl)propan-2-amine?
The IUPAC name of 2-(3,5-dichlorophenyl)propan-2-amine (CID 11195052) is 2-(3,5-dichlorophenyl)propan-2-amine.
What is the SMILES notation for 2-(3,5-dichlorophenyl)propan-2-amine?
The canonical SMILES for 2-(3,5-dichlorophenyl)propan-2-amine is CC(C)(N)c1cc(Cl)cc(Cl)c1.
What is the InChIKey of 2-(3,5-dichlorophenyl)propan-2-amine?
The InChIKey is AZEJGVWRTXUSHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11Cl2N/c1-9(2,12)6-3-7(10)5-8(11)4-6/h3-5H,12H2,1-2H3.
What are the key properties of 2-(3,5-dichlorophenyl)propan-2-amine?
2-(3,5-dichlorophenyl)propan-2-amine has a molecular weight of 204.10 g/mol, XLogP of 3.19, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dichlorophenyl)propan-2-amine is sourced from PubChem (CID 11195052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).