3,5-dibromo-N-(3,3-dimethylbutan-2-yl)pyridin-2-amine

C11H16Br2N2 — CID 104828759

IUPAC3,5-dibromo-N-(3,3-dimethylbutan-2-yl)pyridin-2-amine
SMILESCC(Nc1ncc(Br)cc1Br)C(C)(C)C
InChIInChI=1S/C11H16Br2N2/c1-7(11(2,3)4)15-10-9(13)5-8(12)6-14-10/h5-7H,1-4H3,(H,14,15)
InChIKeyIGTLSVWOPBPLCN-UHFFFAOYSA-N
MW336.07 g/mol
LogP4.45
Rot. Bonds2

About 3,5-dibromo-N-(3,3-dimethylbutan-2-yl)pyridin-2-amine

3,5-dibromo-N-(3,3-dimethylbutan-2-yl)pyridin-2-amine (PubChem CID 104828759) has the molecular formula C11H16Br2N2 and a molecular weight of 336.07 g/mol. Its IUPAC name is 3,5-dibromo-N-(3,3-dimethylbutan-2-yl)pyridin-2-amine.

Molecular Properties

Compound Name3,5-dibromo-N-(3,3-dimethylbutan-2-yl)pyridin-2-amine
PubChem CID104828759
Molecular FormulaC11H16Br2N2
Molecular Weight336.07 g/mol
Exact Mass333.97
IUPAC Name3,5-dibromo-N-(3,3-dimethylbutan-2-yl)pyridin-2-amine
SMILESCC(Nc1ncc(Br)cc1Br)C(C)(C)C
InChIInChI=1S/C11H16Br2N2/c1-7(11(2,3)4)15-10-9(13)5-8(12)6-14-10/h5-7H,1-4H3,(H,14,15)
InChIKeyIGTLSVWOPBPLCN-UHFFFAOYSA-N
XLogP4.45
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.07
LogP ≤ 54.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3,5-dibromo-N-(3,3-dimethylbutan-2-yl)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

3-bromo-2-N-(3,3-dimethylbutan-2-yl)pyridine-2,5-diamine
CID 104827426
3,5-dibromo-N-(1-chloro-4,4-dimethylpentan-3-yl)pyridin-2-amine
CID 106354418
3,5-dibromo-N-(2-propan-2-yloxyethyl)pyridin-2-amine
CID 104762434
3,5-dibromo-N-hex-1-yn-3-ylpyridin-2-amine
CID 106231623
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-[[(1R,2R)-2-ethylcyclopropyl]methyl]pyridin-2-amine
CID 130921142
3-bromo-N-(3,3-dimethylbutan-2-yl)-4-methylpyridin-2-amine
CID 106875908
N-(3,3-dimethylbutan-2-yl)-5-methylpyridin-3-amine
CID 115922281
3,5-dibromo-N-(5-chloro-2,2-dimethylpentyl)pyridin-2-amine
CID 106141963
2-amino-5-bromo-N-(3,3-dimethylbutan-2-yl)pyridine-3-carboxamide
CID 113458035
3,5-dibromo-N-(3,5-dimethoxyphenyl)pyridin-2-amine
CID 113413780

Frequently Asked Questions

What is the IUPAC name of 3,5-dibromo-N-(3,3-dimethylbutan-2-yl)pyridin-2-amine?
The IUPAC name of 3,5-dibromo-N-(3,3-dimethylbutan-2-yl)pyridin-2-amine (CID 104828759) is 3,5-dibromo-N-(3,3-dimethylbutan-2-yl)pyridin-2-amine.
What is the SMILES notation for 3,5-dibromo-N-(3,3-dimethylbutan-2-yl)pyridin-2-amine?
The canonical SMILES for 3,5-dibromo-N-(3,3-dimethylbutan-2-yl)pyridin-2-amine is CC(Nc1ncc(Br)cc1Br)C(C)(C)C.
What is the InChIKey of 3,5-dibromo-N-(3,3-dimethylbutan-2-yl)pyridin-2-amine?
The InChIKey is IGTLSVWOPBPLCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16Br2N2/c1-7(11(2,3)4)15-10-9(13)5-8(12)6-14-10/h5-7H,1-4H3,(H,14,15).
What are the key properties of 3,5-dibromo-N-(3,3-dimethylbutan-2-yl)pyridin-2-amine?
3,5-dibromo-N-(3,3-dimethylbutan-2-yl)pyridin-2-amine has a molecular weight of 336.07 g/mol, XLogP of 4.45, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dibromo-N-(3,3-dimethylbutan-2-yl)pyridin-2-amine is sourced from PubChem (CID 104828759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).