1-[5-(2,3-dichlorophenyl)furan-2-yl]propan-2-amine

C13H13Cl2NO — CID 55180544

IUPAC1-[5-(2,3-dichlorophenyl)furan-2-yl]propan-2-amine
SMILESCC(N)Cc1ccc(-c2cccc(Cl)c2Cl)o1
InChIInChI=1S/C13H13Cl2NO/c1-8(16)7-9-5-6-12(17-9)10-3-2-4-11(14)13(10)15/h2-6,8H,7,16H2,1H3
InChIKeyOYVPZEGZALKZJF-UHFFFAOYSA-N
MW270.16 g/mol
LogP4.14
Rot. Bonds3

About 1-[5-(2,3-dichlorophenyl)furan-2-yl]propan-2-amine

1-[5-(2,3-dichlorophenyl)furan-2-yl]propan-2-amine (PubChem CID 55180544) has the molecular formula C13H13Cl2NO and a molecular weight of 270.16 g/mol. Its IUPAC name is 1-[5-(2,3-dichlorophenyl)furan-2-yl]propan-2-amine.

Molecular Properties

Compound Name1-[5-(2,3-dichlorophenyl)furan-2-yl]propan-2-amine
PubChem CID55180544
Molecular FormulaC13H13Cl2NO
Molecular Weight270.16 g/mol
Exact Mass269.04
IUPAC Name1-[5-(2,3-dichlorophenyl)furan-2-yl]propan-2-amine
SMILESCC(N)Cc1ccc(-c2cccc(Cl)c2Cl)o1
InChIInChI=1S/C13H13Cl2NO/c1-8(16)7-9-5-6-12(17-9)10-3-2-4-11(14)13(10)15/h2-6,8H,7,16H2,1H3
InChIKeyOYVPZEGZALKZJF-UHFFFAOYSA-N
XLogP4.14
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.16
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[5-(2-bromophenyl)furan-2-yl]propan-2-amine
CID 63084768
1-[5-(2-chloro-4-fluorophenyl)furan-2-yl]propan-2-amine
CID 63085980
1-[5-(2-chloro-4-nitrophenyl)furan-2-yl]propan-2-amine
CID 63085115
1-[5-(3-chloro-2-methylphenyl)furan-2-yl]-N-methylpropan-2-amine
CID 63085456
[5-(2,3-dichlorophenyl)furan-2-yl]methyl 4-propan-2-yloxybenzoate
CID 19631409
1-(7-chloro-1-benzofuran-2-yl)propan-2-amine
CID 114735430
[5-(2,3-dichlorophenyl)furan-2-yl]methyl 3,5-dimethoxybenzoate
CID 19631643
[5-(2,3-dichlorophenyl)furan-2-yl]methyl 2-(4-methylphenoxy)acetate
CID 19630207
[5-(2,3-dichlorophenyl)furan-2-yl]methyl 3-chloro-4-methoxybenzoate
CID 22775868
3-[5-(3-chloro-2-methylphenyl)furan-2-yl]propanamide
CID 91686842
[5-(2,3-dichlorophenyl)furan-2-yl]methyl 2-chloro-5-iodobenzoate
CID 23100763
1-[5-(2,3-dimethylphenyl)furan-2-yl]propan-2-ol
CID 63085302

Frequently Asked Questions

What is the IUPAC name of 1-[5-(2,3-dichlorophenyl)furan-2-yl]propan-2-amine?
The IUPAC name of 1-[5-(2,3-dichlorophenyl)furan-2-yl]propan-2-amine (CID 55180544) is 1-[5-(2,3-dichlorophenyl)furan-2-yl]propan-2-amine.
What is the SMILES notation for 1-[5-(2,3-dichlorophenyl)furan-2-yl]propan-2-amine?
The canonical SMILES for 1-[5-(2,3-dichlorophenyl)furan-2-yl]propan-2-amine is CC(N)Cc1ccc(-c2cccc(Cl)c2Cl)o1.
What is the InChIKey of 1-[5-(2,3-dichlorophenyl)furan-2-yl]propan-2-amine?
The InChIKey is OYVPZEGZALKZJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13Cl2NO/c1-8(16)7-9-5-6-12(17-9)10-3-2-4-11(14)13(10)15/h2-6,8H,7,16H2,1H3.
What are the key properties of 1-[5-(2,3-dichlorophenyl)furan-2-yl]propan-2-amine?
1-[5-(2,3-dichlorophenyl)furan-2-yl]propan-2-amine has a molecular weight of 270.16 g/mol, XLogP of 4.14, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(2,3-dichlorophenyl)furan-2-yl]propan-2-amine is sourced from PubChem (CID 55180544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).