2-(4-bromo-2-fluorophenyl)-2-(cyclopentylamino)acetamide

C13H16BrFN2O — CID 54894373

IUPAC2-(4-bromo-2-fluorophenyl)-2-(cyclopentylamino)acetamide
SMILESNC(=O)C(NC1CCCC1)c1ccc(Br)cc1F
InChIInChI=1S/C13H16BrFN2O/c14-8-5-6-10(11(15)7-8)12(13(16)18)17-9-3-1-2-4-9/h5-7,9,12,17H,1-4H2,(H2,16,18)
InChIKeyCQFKDFJYJKQRLE-UHFFFAOYSA-N
MW315.19 g/mol
LogP2.65
Rot. Bonds4

About 2-(4-bromo-2-fluorophenyl)-2-(cyclopentylamino)acetamide

2-(4-bromo-2-fluorophenyl)-2-(cyclopentylamino)acetamide (PubChem CID 54894373) has the molecular formula C13H16BrFN2O and a molecular weight of 315.19 g/mol. Its IUPAC name is 2-(4-bromo-2-fluorophenyl)-2-(cyclopentylamino)acetamide.

Molecular Properties

Compound Name2-(4-bromo-2-fluorophenyl)-2-(cyclopentylamino)acetamide
PubChem CID54894373
Molecular FormulaC13H16BrFN2O
Molecular Weight315.19 g/mol
Exact Mass314.04
IUPAC Name2-(4-bromo-2-fluorophenyl)-2-(cyclopentylamino)acetamide
SMILESNC(=O)C(NC1CCCC1)c1ccc(Br)cc1F
InChIInChI=1S/C13H16BrFN2O/c14-8-5-6-10(11(15)7-8)12(13(16)18)17-9-3-1-2-4-9/h5-7,9,12,17H,1-4H2,(H2,16,18)
InChIKeyCQFKDFJYJKQRLE-UHFFFAOYSA-N
XLogP2.65
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.19
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-bromo-2-fluorophenyl)-2-(cyclohexylamino)acetamide
CID 54894057
2-(cyclopropylamino)-2-(2,4-difluorophenyl)acetamide
CID 60796444
2-(cyclopentylamino)-2-(2-fluorophenyl)acetamide
CID 54894042
2-(5-bromo-2-methoxyphenyl)-2-(cyclopentylamino)acetamide
CID 54894280
2-(4-bromo-2-fluorophenyl)-2-(oxan-2-ylmethylamino)acetamide
CID 71990927
2-(cyclopropylamino)-2-(2,5-difluorophenyl)acetamide
CID 60796305
ethyl 2-(5-bromo-2-fluorophenyl)-2-(cyclopentylamino)acetate
CID 60998047
2-(cyclohexylamino)-2-(2,4-dichlorophenyl)acetamide
CID 54894576
2-(cyclohexylamino)-2-(2,4-difluorophenyl)acetic acid
CID 54892642
2-(4-bromo-2-fluorophenyl)-2-(cyclopentylamino)acetonitrile
CID 54894227
(2S)-2-(4-bromo-2-fluorophenyl)-2-cyclopentylacetic acid
CID 125466606
(R)-(4-bromo-2-fluorophenyl)-cyclopentylmethanol
CID 96691275

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromo-2-fluorophenyl)-2-(cyclopentylamino)acetamide?
The IUPAC name of 2-(4-bromo-2-fluorophenyl)-2-(cyclopentylamino)acetamide (CID 54894373) is 2-(4-bromo-2-fluorophenyl)-2-(cyclopentylamino)acetamide.
What is the SMILES notation for 2-(4-bromo-2-fluorophenyl)-2-(cyclopentylamino)acetamide?
The canonical SMILES for 2-(4-bromo-2-fluorophenyl)-2-(cyclopentylamino)acetamide is NC(=O)C(NC1CCCC1)c1ccc(Br)cc1F.
What is the InChIKey of 2-(4-bromo-2-fluorophenyl)-2-(cyclopentylamino)acetamide?
The InChIKey is CQFKDFJYJKQRLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16BrFN2O/c14-8-5-6-10(11(15)7-8)12(13(16)18)17-9-3-1-2-4-9/h5-7,9,12,17H,1-4H2,(H2,16,18).
What are the key properties of 2-(4-bromo-2-fluorophenyl)-2-(cyclopentylamino)acetamide?
2-(4-bromo-2-fluorophenyl)-2-(cyclopentylamino)acetamide has a molecular weight of 315.19 g/mol, XLogP of 2.65, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromo-2-fluorophenyl)-2-(cyclopentylamino)acetamide is sourced from PubChem (CID 54894373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).