2-(benzylamino)-2-(2-bromophenyl)acetamide

C15H15BrN2O — CID 54889282

IUPAC2-(benzylamino)-2-(2-bromophenyl)acetamide
SMILESNC(=O)C(NCc1ccccc1)c1ccccc1Br
InChIInChI=1S/C15H15BrN2O/c16-13-9-5-4-8-12(13)14(15(17)19)18-10-11-6-2-1-3-7-11/h1-9,14,18H,10H2,(H2,17,19)
InChIKeyXWGXKGZXOKDVKZ-UHFFFAOYSA-N
MW319.20 g/mol
LogP2.77
Rot. Bonds5

About 2-(benzylamino)-2-(2-bromophenyl)acetamide

2-(benzylamino)-2-(2-bromophenyl)acetamide (PubChem CID 54889282) has the molecular formula C15H15BrN2O and a molecular weight of 319.20 g/mol. Its IUPAC name is 2-(benzylamino)-2-(2-bromophenyl)acetamide.

Molecular Properties

Compound Name2-(benzylamino)-2-(2-bromophenyl)acetamide
PubChem CID54889282
Molecular FormulaC15H15BrN2O
Molecular Weight319.20 g/mol
Exact Mass318.04
IUPAC Name2-(benzylamino)-2-(2-bromophenyl)acetamide
SMILESNC(=O)C(NCc1ccccc1)c1ccccc1Br
InChIInChI=1S/C15H15BrN2O/c16-13-9-5-4-8-12(13)14(15(17)19)18-10-11-6-2-1-3-7-11/h1-9,14,18H,10H2,(H2,17,19)
InChIKeyXWGXKGZXOKDVKZ-UHFFFAOYSA-N
XLogP2.77
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.20
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

ethyl 2-(benzylamino)-2-(2-bromophenyl)acetate
CID 60992016
2-(2-bromophenyl)-2-(cyclopropylmethylamino)acetamide
CID 60996640
2-(benzylamino)-2-(4-bromo-5-chlorothiophen-2-yl)acetamide
CID 102840225
2-(benzylamino)-2-(3-bromo-4-methylphenyl)acetamide
CID 105401783
2-(benzylamino)-2-(4-bromo-3-fluorophenyl)acetamide
CID 81436090
2-(1-benzothiophen-3-yl)-2-(benzylamino)acetamide
CID 62698319
2-(2-bromophenyl)-2-[2-(diethylamino)ethylamino]acetamide
CID 54941562
2-(2-bromoanilino)-2-(2-bromophenyl)acetamide
CID 54892174
2-(benzylamino)-2-[4-(difluoromethyl)phenyl]acetamide
CID 115524447
(2R)-2-(benzylamino)-2-(4-methylphenyl)acetamide
CID 10824853
N-benzyl-2-[[(1S)-1-(2-bromophenyl)ethyl]amino]acetamide
CID 81378591
(2S)-2-(benzylamino)-2-(2-fluorophenyl)acetic acid
CID 26985403

Frequently Asked Questions

What is the IUPAC name of 2-(benzylamino)-2-(2-bromophenyl)acetamide?
The IUPAC name of 2-(benzylamino)-2-(2-bromophenyl)acetamide (CID 54889282) is 2-(benzylamino)-2-(2-bromophenyl)acetamide.
What is the SMILES notation for 2-(benzylamino)-2-(2-bromophenyl)acetamide?
The canonical SMILES for 2-(benzylamino)-2-(2-bromophenyl)acetamide is NC(=O)C(NCc1ccccc1)c1ccccc1Br.
What is the InChIKey of 2-(benzylamino)-2-(2-bromophenyl)acetamide?
The InChIKey is XWGXKGZXOKDVKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15BrN2O/c16-13-9-5-4-8-12(13)14(15(17)19)18-10-11-6-2-1-3-7-11/h1-9,14,18H,10H2,(H2,17,19).
What are the key properties of 2-(benzylamino)-2-(2-bromophenyl)acetamide?
2-(benzylamino)-2-(2-bromophenyl)acetamide has a molecular weight of 319.20 g/mol, XLogP of 2.77, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzylamino)-2-(2-bromophenyl)acetamide is sourced from PubChem (CID 54889282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).