5-bromo-N-[1-(furan-2-yl)propan-2-yl]-4-methylpyridin-2-amine

C13H15BrN2O — CID 115773907

IUPAC5-bromo-N-[1-(furan-2-yl)propan-2-yl]-4-methylpyridin-2-amine
SMILESCc1cc(NC(C)Cc2ccco2)ncc1Br
InChIInChI=1S/C13H15BrN2O/c1-9-6-13(15-8-12(9)14)16-10(2)7-11-4-3-5-17-11/h3-6,8,10H,7H2,1-2H3,(H,15,16)
InChIKeyYSNYDUFYHUQLPF-UHFFFAOYSA-N
MW295.18 g/mol
LogP3.79
Rot. Bonds4

About 5-bromo-N-[1-(furan-2-yl)propan-2-yl]-4-methylpyridin-2-amine

5-bromo-N-[1-(furan-2-yl)propan-2-yl]-4-methylpyridin-2-amine (PubChem CID 115773907) has the molecular formula C13H15BrN2O and a molecular weight of 295.18 g/mol. Its IUPAC name is 5-bromo-N-[1-(furan-2-yl)propan-2-yl]-4-methylpyridin-2-amine.

Molecular Properties

Compound Name5-bromo-N-[1-(furan-2-yl)propan-2-yl]-4-methylpyridin-2-amine
PubChem CID115773907
Molecular FormulaC13H15BrN2O
Molecular Weight295.18 g/mol
Exact Mass294.04
IUPAC Name5-bromo-N-[1-(furan-2-yl)propan-2-yl]-4-methylpyridin-2-amine
SMILESCc1cc(NC(C)Cc2ccco2)ncc1Br
InChIInChI=1S/C13H15BrN2O/c1-9-6-13(15-8-12(9)14)16-10(2)7-11-4-3-5-17-11/h3-6,8,10H,7H2,1-2H3,(H,15,16)
InChIKeyYSNYDUFYHUQLPF-UHFFFAOYSA-N
XLogP3.79
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.18
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-bromo-N-[1-(furan-2-yl)propan-2-yl]-4-methylpyridin-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

2-N-[4-(furan-2-yl)butan-2-yl]-4-methylpyridine-2,5-diamine
CID 79173050
(2S)-2-[(5-bromo-4-methyl-2-pyridinyl)amino]-2-(furan-2-yl)ethanol
CID 99776461
N-[1-(furan-2-yl)propan-2-yl]-4-(trifluoromethyl)pyridin-2-amine
CID 66330241
N-[1-(furan-2-yl)propan-2-yl]-5-methylpyridin-3-amine
CID 107584649
N-[1-(furan-2-yl)propan-2-yl]-3,5-dimethylaniline
CID 63099916
N-[1-(furan-2-yl)propan-2-yl]-5-iodopyrimidin-2-amine
CID 104840074
N-[1-(furan-2-yl)propan-2-yl]-6-hydrazinylpyrazin-2-amine
CID 80896852
6-bromo-N-[1-(furan-2-yl)propan-2-yl]-2,3-dihydro-1,4-benzodioxin-7-amine
CID 63085271
4-N-[1-(furan-2-yl)propan-2-yl]-6-(trifluoromethyl)pyrimidine-2,4-diamine
CID 114564446
4-N-[1-(furan-2-yl)propan-2-yl]-6-methoxypyrimidine-2,4-diamine
CID 114053032
2-N-ethyl-4-N-[1-(furan-2-yl)propan-2-yl]-6-methylpyrimidine-2,4-diamine
CID 80803462
1-(furan-2-yl)-N-[1-(furan-2-yl)propan-2-yl]propan-2-amine
CID 55179966

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-[1-(furan-2-yl)propan-2-yl]-4-methylpyridin-2-amine?
The IUPAC name of 5-bromo-N-[1-(furan-2-yl)propan-2-yl]-4-methylpyridin-2-amine (CID 115773907) is 5-bromo-N-[1-(furan-2-yl)propan-2-yl]-4-methylpyridin-2-amine.
What is the SMILES notation for 5-bromo-N-[1-(furan-2-yl)propan-2-yl]-4-methylpyridin-2-amine?
The canonical SMILES for 5-bromo-N-[1-(furan-2-yl)propan-2-yl]-4-methylpyridin-2-amine is Cc1cc(NC(C)Cc2ccco2)ncc1Br.
What is the InChIKey of 5-bromo-N-[1-(furan-2-yl)propan-2-yl]-4-methylpyridin-2-amine?
The InChIKey is YSNYDUFYHUQLPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15BrN2O/c1-9-6-13(15-8-12(9)14)16-10(2)7-11-4-3-5-17-11/h3-6,8,10H,7H2,1-2H3,(H,15,16).
What are the key properties of 5-bromo-N-[1-(furan-2-yl)propan-2-yl]-4-methylpyridin-2-amine?
5-bromo-N-[1-(furan-2-yl)propan-2-yl]-4-methylpyridin-2-amine has a molecular weight of 295.18 g/mol, XLogP of 3.79, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-[1-(furan-2-yl)propan-2-yl]-4-methylpyridin-2-amine is sourced from PubChem (CID 115773907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).