(2R)-N-(3-bromophenyl)-2-methylbutanamide

C11H14BrNO — CID 670010

IUPAC(2R)-N-(3-bromophenyl)-2-methylbutanamide
SMILESCC[C@@H](C)C(=O)Nc1cccc(Br)c1
InChIInChI=1S/C11H14BrNO/c1-3-8(2)11(14)13-10-6-4-5-9(12)7-10/h4-8H,3H2,1-2H3,(H,13,14)/t8-/m1/s1
InChIKeyGBFFKBVNTNCQLG-MRVPVSSYSA-N
MW256.14 g/mol
LogP3.43
Rot. Bonds3

About (2R)-N-(3-bromophenyl)-2-methylbutanamide

(2R)-N-(3-bromophenyl)-2-methylbutanamide (PubChem CID 670010) has the molecular formula C11H14BrNO and a molecular weight of 256.14 g/mol. Its IUPAC name is (2R)-N-(3-bromophenyl)-2-methylbutanamide.

Molecular Properties

Compound Name(2R)-N-(3-bromophenyl)-2-methylbutanamide
PubChem CID670010
Molecular FormulaC11H14BrNO
Molecular Weight256.14 g/mol
Exact Mass255.03
IUPAC Name(2R)-N-(3-bromophenyl)-2-methylbutanamide
SMILESCC[C@@H](C)C(=O)Nc1cccc(Br)c1
InChIInChI=1S/C11H14BrNO/c1-3-8(2)11(14)13-10-6-4-5-9(12)7-10/h4-8H,3H2,1-2H3,(H,13,14)/t8-/m1/s1
InChIKeyGBFFKBVNTNCQLG-MRVPVSSYSA-N
XLogP3.43
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.14
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(3-bromophenyl)-2-hydroxypropanamide
CID 82130318
(2S)-N-(3-aminophenyl)-2-methylbutanamide
CID 40788840
2-bromo-N-(3-bromophenyl)-3-methylbutanamide
CID 24698066
N-(3-chlorophenyl)-2-methylbutanamide
CID 4636150
2-(aminomethyl)-N-(3-bromophenyl)-3-methylbutanamide
CID 65226098
2-methyl-N-[3-[1-(methylamino)ethyl]phenyl]butanamide
CID 43507778
N-(3-bromophenyl)-2-[2-hydroxyethyl(methyl)amino]propanamide
CID 110880847
3-[[1-(3-bromoanilino)-1-oxopropan-2-yl]-methylamino]-2-methylpropanoic acid
CID 122120144
N-(3-bromophenyl)-4-methyl-3-oxopentanamide
CID 134357858
N-[3-[1-(ethylamino)ethyl]phenyl]-2-methylbutanamide
CID 43507836
2-methyl-N-(3-phenoxyphenyl)butanamide
CID 53364670
(2R)-2-(3-bromoanilino)-N-(3-methylphenyl)propanamide
CID 2464663

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(3-bromophenyl)-2-methylbutanamide?
The IUPAC name of (2R)-N-(3-bromophenyl)-2-methylbutanamide (CID 670010) is (2R)-N-(3-bromophenyl)-2-methylbutanamide.
What is the SMILES notation for (2R)-N-(3-bromophenyl)-2-methylbutanamide?
The canonical SMILES for (2R)-N-(3-bromophenyl)-2-methylbutanamide is CC[C@@H](C)C(=O)Nc1cccc(Br)c1.
What is the InChIKey of (2R)-N-(3-bromophenyl)-2-methylbutanamide?
The InChIKey is GBFFKBVNTNCQLG-MRVPVSSYSA-N. The full InChI is InChI=1S/C11H14BrNO/c1-3-8(2)11(14)13-10-6-4-5-9(12)7-10/h4-8H,3H2,1-2H3,(H,13,14)/t8-/m1/s1.
What are the key properties of (2R)-N-(3-bromophenyl)-2-methylbutanamide?
(2R)-N-(3-bromophenyl)-2-methylbutanamide has a molecular weight of 256.14 g/mol, XLogP of 3.43, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(3-bromophenyl)-2-methylbutanamide is sourced from PubChem (CID 670010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).