3,5-dibromo-N-(2-propan-2-yloxyethyl)pyridin-2-amine

C10H14Br2N2O — CID 104762434

IUPAC3,5-dibromo-N-(2-propan-2-yloxyethyl)pyridin-2-amine
SMILESCC(C)OCCNc1ncc(Br)cc1Br
InChIInChI=1S/C10H14Br2N2O/c1-7(2)15-4-3-13-10-9(12)5-8(11)6-14-10/h5-7H,3-4H2,1-2H3,(H,13,14)
InChIKeyRNQBGPNORXPFHA-UHFFFAOYSA-N
MW338.04 g/mol
LogP3.44
Rot. Bonds5

About 3,5-dibromo-N-(2-propan-2-yloxyethyl)pyridin-2-amine

3,5-dibromo-N-(2-propan-2-yloxyethyl)pyridin-2-amine (PubChem CID 104762434) has the molecular formula C10H14Br2N2O and a molecular weight of 338.04 g/mol. Its IUPAC name is 3,5-dibromo-N-(2-propan-2-yloxyethyl)pyridin-2-amine.

Molecular Properties

Compound Name3,5-dibromo-N-(2-propan-2-yloxyethyl)pyridin-2-amine
PubChem CID104762434
Molecular FormulaC10H14Br2N2O
Molecular Weight338.04 g/mol
Exact Mass335.95
IUPAC Name3,5-dibromo-N-(2-propan-2-yloxyethyl)pyridin-2-amine
SMILESCC(C)OCCNc1ncc(Br)cc1Br
InChIInChI=1S/C10H14Br2N2O/c1-7(2)15-4-3-13-10-9(12)5-8(11)6-14-10/h5-7H,3-4H2,1-2H3,(H,13,14)
InChIKeyRNQBGPNORXPFHA-UHFFFAOYSA-N
XLogP3.44
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.04
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 3,5-dibromo-N-(2-propan-2-yloxyethyl)pyridin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-bromo-3-fluoro-N-(4-propan-2-yloxybutyl)pyridin-2-amine
CID 104925322
5-bromo-2-(ethylamino)-N-(2-propan-2-yloxyethyl)pyridine-3-sulfonamide
CID 104765396
3,5-dibromo-N-(3-phenoxypropyl)pyridin-2-amine
CID 113413693
3,5-dibromo-N-(2-chloro-4-methylpentyl)pyridin-2-amine
CID 107156387
1-N-(3,5-dibromo-2-pyridinyl)-4-methylpentane-1,2-diamine
CID 107159277
3,5-dibromo-N-(3,3-dimethylbutan-2-yl)pyridin-2-amine
CID 104828759
5-bromo-3-methyl-N-[3-(2-methylpropoxy)propyl]pyridin-2-amine
CID 113252097
3-bromo-2-N-[3-(2-methylpropoxy)propyl]pyridine-2,5-diamine
CID 114097536
3,5-dibromo-N-[2-(2-methylphenyl)ethyl]pyridin-2-amine
CID 113413714
3,5-dibromo-N-[2-(3,5-difluorophenyl)ethyl]pyridin-2-amine
CID 113413696
5-bromo-2-(ethylamino)-N-methyl-N-(2-propan-2-yloxyethyl)pyridine-3-carboxamide
CID 81075105
5-bromo-3-fluoro-N-(3-propan-2-yloxybutyl)pyridin-2-amine
CID 146237825

Frequently Asked Questions

What is the IUPAC name of 3,5-dibromo-N-(2-propan-2-yloxyethyl)pyridin-2-amine?
The IUPAC name of 3,5-dibromo-N-(2-propan-2-yloxyethyl)pyridin-2-amine (CID 104762434) is 3,5-dibromo-N-(2-propan-2-yloxyethyl)pyridin-2-amine.
What is the SMILES notation for 3,5-dibromo-N-(2-propan-2-yloxyethyl)pyridin-2-amine?
The canonical SMILES for 3,5-dibromo-N-(2-propan-2-yloxyethyl)pyridin-2-amine is CC(C)OCCNc1ncc(Br)cc1Br.
What is the InChIKey of 3,5-dibromo-N-(2-propan-2-yloxyethyl)pyridin-2-amine?
The InChIKey is RNQBGPNORXPFHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14Br2N2O/c1-7(2)15-4-3-13-10-9(12)5-8(11)6-14-10/h5-7H,3-4H2,1-2H3,(H,13,14).
What are the key properties of 3,5-dibromo-N-(2-propan-2-yloxyethyl)pyridin-2-amine?
3,5-dibromo-N-(2-propan-2-yloxyethyl)pyridin-2-amine has a molecular weight of 338.04 g/mol, XLogP of 3.44, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dibromo-N-(2-propan-2-yloxyethyl)pyridin-2-amine is sourced from PubChem (CID 104762434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).