2-amino-N-(5-bromo-2-chlorophenyl)-2-cyclopropylpropanamide

C12H14BrClN2O — CID 62908062

IUPAC2-amino-N-(5-bromo-2-chlorophenyl)-2-cyclopropylpropanamide
SMILESCC(N)(C(=O)Nc1cc(Br)ccc1Cl)C1CC1
InChIInChI=1S/C12H14BrClN2O/c1-12(15,7-2-3-7)11(17)16-10-6-8(13)4-5-9(10)14/h4-7H,2-3,15H2,1H3,(H,16,17)
InChIKeyPCMSNBUCIVJPLF-UHFFFAOYSA-N
MW317.61 g/mol
LogP3.17
Rot. Bonds3

About 2-amino-N-(5-bromo-2-chlorophenyl)-2-cyclopropylpropanamide

2-amino-N-(5-bromo-2-chlorophenyl)-2-cyclopropylpropanamide (PubChem CID 62908062) has the molecular formula C12H14BrClN2O and a molecular weight of 317.61 g/mol. Its IUPAC name is 2-amino-N-(5-bromo-2-chlorophenyl)-2-cyclopropylpropanamide.

Molecular Properties

Compound Name2-amino-N-(5-bromo-2-chlorophenyl)-2-cyclopropylpropanamide
PubChem CID62908062
Molecular FormulaC12H14BrClN2O
Molecular Weight317.61 g/mol
Exact Mass316.00
IUPAC Name2-amino-N-(5-bromo-2-chlorophenyl)-2-cyclopropylpropanamide
SMILESCC(N)(C(=O)Nc1cc(Br)ccc1Cl)C1CC1
InChIInChI=1S/C12H14BrClN2O/c1-12(15,7-2-3-7)11(17)16-10-6-8(13)4-5-9(10)14/h4-7H,2-3,15H2,1H3,(H,16,17)
InChIKeyPCMSNBUCIVJPLF-UHFFFAOYSA-N
XLogP3.17
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.61
LogP ≤ 53.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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3-[(2-amino-2-cyclopropylpropanoyl)amino]-4-chloro-N-methylbenzamide
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2-amino-N-(2-chloro-5-sulfamoylphenyl)-2-cyclopropylpropanamide
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N-(5-bromo-2-chlorophenyl)-2-methyl-2-piperidin-3-ylpropanamide
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2-amino-N-(2-chloro-4-nitrophenyl)-2-cyclopropylpropanamide
CID 54925136
N-(5-bromo-2-chlorophenyl)-2-cyclobutylacetamide
CID 103707266
2-amino-2-cyclopropyl-N-(2,4-dimethylphenyl)propanamide
CID 60868406
N-(5-bromo-2-chlorophenyl)tricyclo[3.2.1.02,4]octane-3-carboxamide
CID 103760899
1-(5-bromo-2-chlorophenyl)-3-(4-hydroxycyclohexyl)urea
CID 56824183
2-amino-2-cyclopropyl-N-(2,3-dimethylphenyl)propanamide
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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(5-bromo-2-chlorophenyl)-2-cyclopropylpropanamide?
The IUPAC name of 2-amino-N-(5-bromo-2-chlorophenyl)-2-cyclopropylpropanamide (CID 62908062) is 2-amino-N-(5-bromo-2-chlorophenyl)-2-cyclopropylpropanamide.
What is the SMILES notation for 2-amino-N-(5-bromo-2-chlorophenyl)-2-cyclopropylpropanamide?
The canonical SMILES for 2-amino-N-(5-bromo-2-chlorophenyl)-2-cyclopropylpropanamide is CC(N)(C(=O)Nc1cc(Br)ccc1Cl)C1CC1.
What is the InChIKey of 2-amino-N-(5-bromo-2-chlorophenyl)-2-cyclopropylpropanamide?
The InChIKey is PCMSNBUCIVJPLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14BrClN2O/c1-12(15,7-2-3-7)11(17)16-10-6-8(13)4-5-9(10)14/h4-7H,2-3,15H2,1H3,(H,16,17).
What are the key properties of 2-amino-N-(5-bromo-2-chlorophenyl)-2-cyclopropylpropanamide?
2-amino-N-(5-bromo-2-chlorophenyl)-2-cyclopropylpropanamide has a molecular weight of 317.61 g/mol, XLogP of 3.17, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(5-bromo-2-chlorophenyl)-2-cyclopropylpropanamide is sourced from PubChem (CID 62908062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).