2-amino-N-(2,6-dibromophenyl)propanamide

C9H10Br2N2O — CID 12546848

IUPAC2-amino-N-(2,6-dibromophenyl)propanamide
SMILESCC(N)C(=O)Nc1c(Br)cccc1Br
InChIInChI=1S/C9H10Br2N2O/c1-5(12)9(14)13-8-6(10)3-2-4-7(8)11/h2-5H,12H2,1H3,(H,13,14)
InChIKeySVVAHYBHGDCBGP-UHFFFAOYSA-N
MW322.00 g/mol
LogP2.50
Rot. Bonds2

About 2-amino-N-(2,6-dibromophenyl)propanamide

2-amino-N-(2,6-dibromophenyl)propanamide (PubChem CID 12546848) has the molecular formula C9H10Br2N2O and a molecular weight of 322.00 g/mol. Its IUPAC name is 2-amino-N-(2,6-dibromophenyl)propanamide.

Molecular Properties

Compound Name2-amino-N-(2,6-dibromophenyl)propanamide
PubChem CID12546848
Molecular FormulaC9H10Br2N2O
Molecular Weight322.00 g/mol
Exact Mass319.92
IUPAC Name2-amino-N-(2,6-dibromophenyl)propanamide
SMILESCC(N)C(=O)Nc1c(Br)cccc1Br
InChIInChI=1S/C9H10Br2N2O/c1-5(12)9(14)13-8-6(10)3-2-4-7(8)11/h2-5H,12H2,1H3,(H,13,14)
InChIKeySVVAHYBHGDCBGP-UHFFFAOYSA-N
XLogP2.50
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.00
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-(2,6-dibromophenyl)-3,3-dimethylbutanamide
CID 107599700
(2S)-2-amino-N-(2-bromophenyl)propanamide
CID 22690580
2-amino-N-(2,6-difluorophenyl)propanamide
CID 43087644
2-(aminomethyl)-N-(2,6-dibromophenyl)butanamide
CID 107599748
2-amino-N-(2-bromo-6-fluorophenyl)butanamide
CID 107599827
(2S)-2-amino-N-(4-bromo-2,6-difluorophenyl)propanamide
CID 79009037
(2S)-2-amino-N-(2-chloro-6-fluorophenyl)propanamide
CID 104877858
(2R)-2-amino-N-phenylpropanamide
CID 10607114
N-(2,6-dibromophenyl)propanamide
CID 103863189
(2R)-2-amino-N-(2-bromo-5-methylphenyl)propanamide
CID 82757390
(2R)-2-amino-N-(6-bromo-3-pyridinyl)propanamide
CID 103813937
2-amino-N-(3-bromo-4-methylphenyl)propanamide
CID 63334898

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2,6-dibromophenyl)propanamide?
The IUPAC name of 2-amino-N-(2,6-dibromophenyl)propanamide (CID 12546848) is 2-amino-N-(2,6-dibromophenyl)propanamide.
What is the SMILES notation for 2-amino-N-(2,6-dibromophenyl)propanamide?
The canonical SMILES for 2-amino-N-(2,6-dibromophenyl)propanamide is CC(N)C(=O)Nc1c(Br)cccc1Br.
What is the InChIKey of 2-amino-N-(2,6-dibromophenyl)propanamide?
The InChIKey is SVVAHYBHGDCBGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10Br2N2O/c1-5(12)9(14)13-8-6(10)3-2-4-7(8)11/h2-5H,12H2,1H3,(H,13,14).
What are the key properties of 2-amino-N-(2,6-dibromophenyl)propanamide?
2-amino-N-(2,6-dibromophenyl)propanamide has a molecular weight of 322.00 g/mol, XLogP of 2.50, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2,6-dibromophenyl)propanamide is sourced from PubChem (CID 12546848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).