4-(5-bromofuran-2-yl)-N-(2-methylpropyl)-1,3-thiazol-2-amine

C11H13BrN2OS — CID 104653304

IUPAC4-(5-bromofuran-2-yl)-N-(2-methylpropyl)-1,3-thiazol-2-amine
SMILESCC(C)CNc1nc(-c2ccc(Br)o2)cs1
InChIInChI=1S/C11H13BrN2OS/c1-7(2)5-13-11-14-8(6-16-11)9-3-4-10(12)15-9/h3-4,6-7H,5H2,1-2H3,(H,13,14)
InChIKeyOSIQNSITLFEQLC-UHFFFAOYSA-N
MW301.21 g/mol
LogP4.23
Rot. Bonds4

About 4-(5-bromofuran-2-yl)-N-(2-methylpropyl)-1,3-thiazol-2-amine

4-(5-bromofuran-2-yl)-N-(2-methylpropyl)-1,3-thiazol-2-amine (PubChem CID 104653304) has the molecular formula C11H13BrN2OS and a molecular weight of 301.21 g/mol. Its IUPAC name is 4-(5-bromofuran-2-yl)-N-(2-methylpropyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(5-bromofuran-2-yl)-N-(2-methylpropyl)-1,3-thiazol-2-amine
PubChem CID104653304
Molecular FormulaC11H13BrN2OS
Molecular Weight301.21 g/mol
Exact Mass299.99
IUPAC Name4-(5-bromofuran-2-yl)-N-(2-methylpropyl)-1,3-thiazol-2-amine
SMILESCC(C)CNc1nc(-c2ccc(Br)o2)cs1
InChIInChI=1S/C11H13BrN2OS/c1-7(2)5-13-11-14-8(6-16-11)9-3-4-10(12)15-9/h3-4,6-7H,5H2,1-2H3,(H,13,14)
InChIKeyOSIQNSITLFEQLC-UHFFFAOYSA-N
XLogP4.23
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.21
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methylpropyl)-4-(4-propan-2-ylphenyl)-1,3-thiazol-2-amine
CID 60642186
N-(2-methylpropyl)-4-(3-methylthiophen-2-yl)-1,3-thiazol-2-amine
CID 63992614
4-(2,4-dimethylphenyl)-N-(2-methylpropyl)-1,3-thiazol-2-amine
CID 55027261
4-(1,3-dimethylpyrazol-4-yl)-N-(2-methylpropyl)-1,3-thiazol-2-amine
CID 63931625
4-(3-fluorophenyl)-N-(2-methylpropyl)-1,3-thiazol-2-amine
CID 9420037
N-[[4-(5-bromofuran-2-yl)-1,3-thiazol-2-yl]methyl]cyclopropanamine
CID 104653522
4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-(2-methylpropyl)-1,3-thiazol-2-amine
CID 9420029
4-[[4-(5-bromofuran-2-yl)-1,3-thiazol-2-yl]methyl]aniline
CID 104653544
N-(2-methylpropyl)-4-(2-propyl-1,3-thiazol-5-yl)-1,3-thiazol-2-amine
CID 82422498
4-(5-bromofuran-2-yl)-2-(4-bromophenyl)-1,3-thiazole
CID 113437726
4-(5-bromofuran-2-yl)-2-(2-bromophenyl)-1,3-thiazole
CID 104654186
2,6-dimethyl-4-[2-(2-methylpropylamino)-1,3-thiazol-4-yl]pyridazin-3-one
CID 82442688

Frequently Asked Questions

What is the IUPAC name of 4-(5-bromofuran-2-yl)-N-(2-methylpropyl)-1,3-thiazol-2-amine?
The IUPAC name of 4-(5-bromofuran-2-yl)-N-(2-methylpropyl)-1,3-thiazol-2-amine (CID 104653304) is 4-(5-bromofuran-2-yl)-N-(2-methylpropyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(5-bromofuran-2-yl)-N-(2-methylpropyl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-(5-bromofuran-2-yl)-N-(2-methylpropyl)-1,3-thiazol-2-amine is CC(C)CNc1nc(-c2ccc(Br)o2)cs1.
What is the InChIKey of 4-(5-bromofuran-2-yl)-N-(2-methylpropyl)-1,3-thiazol-2-amine?
The InChIKey is OSIQNSITLFEQLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13BrN2OS/c1-7(2)5-13-11-14-8(6-16-11)9-3-4-10(12)15-9/h3-4,6-7H,5H2,1-2H3,(H,13,14).
What are the key properties of 4-(5-bromofuran-2-yl)-N-(2-methylpropyl)-1,3-thiazol-2-amine?
4-(5-bromofuran-2-yl)-N-(2-methylpropyl)-1,3-thiazol-2-amine has a molecular weight of 301.21 g/mol, XLogP of 4.23, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-bromofuran-2-yl)-N-(2-methylpropyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 104653304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).