N-(2-bromo-5-chlorophenyl)-2-(cyclopentylamino)acetamide

C13H16BrClN2O — CID 81270958

IUPACN-(2-bromo-5-chlorophenyl)-2-(cyclopentylamino)acetamide
SMILESO=C(CNC1CCCC1)Nc1cc(Cl)ccc1Br
InChIInChI=1S/C13H16BrClN2O/c14-11-6-5-9(15)7-12(11)17-13(18)8-16-10-3-1-2-4-10/h5-7,10,16H,1-4,8H2,(H,17,18)
InChIKeyVIEAXXXDBLPLEA-UHFFFAOYSA-N
MW331.64 g/mol
LogP3.57
Rot. Bonds4

About N-(2-bromo-5-chlorophenyl)-2-(cyclopentylamino)acetamide

N-(2-bromo-5-chlorophenyl)-2-(cyclopentylamino)acetamide (PubChem CID 81270958) has the molecular formula C13H16BrClN2O and a molecular weight of 331.64 g/mol. Its IUPAC name is N-(2-bromo-5-chlorophenyl)-2-(cyclopentylamino)acetamide.

Molecular Properties

Compound NameN-(2-bromo-5-chlorophenyl)-2-(cyclopentylamino)acetamide
PubChem CID81270958
Molecular FormulaC13H16BrClN2O
Molecular Weight331.64 g/mol
Exact Mass330.01
IUPAC NameN-(2-bromo-5-chlorophenyl)-2-(cyclopentylamino)acetamide
SMILESO=C(CNC1CCCC1)Nc1cc(Cl)ccc1Br
InChIInChI=1S/C13H16BrClN2O/c14-11-6-5-9(15)7-12(11)17-13(18)8-16-10-3-1-2-4-10/h5-7,10,16H,1-4,8H2,(H,17,18)
InChIKeyVIEAXXXDBLPLEA-UHFFFAOYSA-N
XLogP3.57
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.64
LogP ≤ 53.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(cyclopentylamino)-N-(2,4-dichlorophenyl)acetamide
CID 9465920
N-(5-chloro-2-methylphenyl)-2-(cyclopropylamino)acetamide
CID 43405290
N-(5-chloro-2-nitrophenyl)-2-(cyclooctylamino)acetamide
CID 9265553
N-(5-bromo-2,4-difluorophenyl)-2-(cyclopentylamino)acetamide
CID 102853789
N-(4-chlorophenyl)-2-(cyclohexylamino)acetamide
CID 788648
N-(5-chloro-2-cyanophenyl)-2-(cyclopropylamino)acetamide
CID 54917775
2-(cyclohexylamino)-N-(2,4,5-trichlorophenyl)acetamide
CID 54815310
N-(2-bromo-5-chlorophenyl)cyclohexanecarboxamide
CID 81272184
N-(3-chlorophenyl)-2-(cycloheptylamino)acetamide
CID 43236492
3-(cyclopentylamino)-N-(2,5-dichlorophenyl)propanamide
CID 109013761
N-(2-bromo-5-chlorophenyl)-2-pyrrolidin-2-ylacetamide
CID 81270551
N-(2-bromo-5-chlorophenyl)cyclobutanecarboxamide
CID 81272636

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-5-chlorophenyl)-2-(cyclopentylamino)acetamide?
The IUPAC name of N-(2-bromo-5-chlorophenyl)-2-(cyclopentylamino)acetamide (CID 81270958) is N-(2-bromo-5-chlorophenyl)-2-(cyclopentylamino)acetamide.
What is the SMILES notation for N-(2-bromo-5-chlorophenyl)-2-(cyclopentylamino)acetamide?
The canonical SMILES for N-(2-bromo-5-chlorophenyl)-2-(cyclopentylamino)acetamide is O=C(CNC1CCCC1)Nc1cc(Cl)ccc1Br.
What is the InChIKey of N-(2-bromo-5-chlorophenyl)-2-(cyclopentylamino)acetamide?
The InChIKey is VIEAXXXDBLPLEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16BrClN2O/c14-11-6-5-9(15)7-12(11)17-13(18)8-16-10-3-1-2-4-10/h5-7,10,16H,1-4,8H2,(H,17,18).
What are the key properties of N-(2-bromo-5-chlorophenyl)-2-(cyclopentylamino)acetamide?
N-(2-bromo-5-chlorophenyl)-2-(cyclopentylamino)acetamide has a molecular weight of 331.64 g/mol, XLogP of 3.57, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromo-5-chlorophenyl)-2-(cyclopentylamino)acetamide is sourced from PubChem (CID 81270958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).