[1-[(5-bromothiophen-2-yl)methyl]cyclobutyl]methanamine

C10H14BrNS — CID 65194183

IUPAC[1-[(5-bromothiophen-2-yl)methyl]cyclobutyl]methanamine
SMILESNCC1(Cc2ccc(Br)s2)CCC1
InChIInChI=1S/C10H14BrNS/c11-9-3-2-8(13-9)6-10(7-12)4-1-5-10/h2-3H,1,4-7,12H2
InChIKeyKYVDUVFBZPDJIS-UHFFFAOYSA-N
MW260.20 g/mol
LogP3.18
Rot. Bonds3

About [1-[(5-bromothiophen-2-yl)methyl]cyclobutyl]methanamine

[1-[(5-bromothiophen-2-yl)methyl]cyclobutyl]methanamine (PubChem CID 65194183) has the molecular formula C10H14BrNS and a molecular weight of 260.20 g/mol. Its IUPAC name is [1-[(5-bromothiophen-2-yl)methyl]cyclobutyl]methanamine.

Molecular Properties

Compound Name[1-[(5-bromothiophen-2-yl)methyl]cyclobutyl]methanamine
PubChem CID65194183
Molecular FormulaC10H14BrNS
Molecular Weight260.20 g/mol
Exact Mass259.00
IUPAC Name[1-[(5-bromothiophen-2-yl)methyl]cyclobutyl]methanamine
SMILESNCC1(Cc2ccc(Br)s2)CCC1
InChIInChI=1S/C10H14BrNS/c11-9-3-2-8(13-9)6-10(7-12)4-1-5-10/h2-3H,1,4-7,12H2
InChIKeyKYVDUVFBZPDJIS-UHFFFAOYSA-N
XLogP3.18
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.20
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [1-[(5-bromothiophen-2-yl)methyl]cyclobutyl]methanamine 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

[1-[(5-bromothiophen-2-yl)methyl]-4-tert-butylcyclohexyl]methanamine
CID 63521616
N-[[1-[(5-bromothiophen-2-yl)methyl]cyclohexyl]methyl]ethanamine
CID 63507818
N-[[1-[(5-bromothiophen-2-yl)methyl]cyclohexyl]methyl]propan-2-amine
CID 63507825
N-[[1-[(5-bromothiophen-2-yl)methyl]cyclopropyl]methyl]propan-1-amine
CID 66023790
N-[[1-(aminomethyl)cyclobutyl]methyl]-5-bromo-N-methylthiophen-2-amine
CID 115245691
1-[(5-bromothiophen-2-yl)methyl]-4,4-dimethylcycloheptan-1-ol
CID 65151707
2-[1-(aminomethyl)cyclohexyl]-N-[(5-bromothiophen-2-yl)methyl]-N-ethylacetamide
CID 104677775
1-[(5-bromothiophen-2-yl)methyl]cyclopropane-1-carboxylic acid
CID 66023531
2-[(5-bromothiophen-2-yl)methyl]-2-propylpyrrolidine
CID 66468528
N-[1-(aminomethyl)cyclopentyl]-2-(5-bromothiophen-2-yl)acetamide
CID 119568476
2-bromo-5-[[1-(bromomethyl)-4-tert-butylcyclohexyl]methyl]thiophene
CID 66048702
[1-[(4-bromothiophen-2-yl)methyl]cyclopropyl]methanamine
CID 66025971

Frequently Asked Questions

What is the IUPAC name of [1-[(5-bromothiophen-2-yl)methyl]cyclobutyl]methanamine?
The IUPAC name of [1-[(5-bromothiophen-2-yl)methyl]cyclobutyl]methanamine (CID 65194183) is [1-[(5-bromothiophen-2-yl)methyl]cyclobutyl]methanamine.
What is the SMILES notation for [1-[(5-bromothiophen-2-yl)methyl]cyclobutyl]methanamine?
The canonical SMILES for [1-[(5-bromothiophen-2-yl)methyl]cyclobutyl]methanamine is NCC1(Cc2ccc(Br)s2)CCC1.
What is the InChIKey of [1-[(5-bromothiophen-2-yl)methyl]cyclobutyl]methanamine?
The InChIKey is KYVDUVFBZPDJIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14BrNS/c11-9-3-2-8(13-9)6-10(7-12)4-1-5-10/h2-3H,1,4-7,12H2.
What are the key properties of [1-[(5-bromothiophen-2-yl)methyl]cyclobutyl]methanamine?
[1-[(5-bromothiophen-2-yl)methyl]cyclobutyl]methanamine has a molecular weight of 260.20 g/mol, XLogP of 3.18, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(5-bromothiophen-2-yl)methyl]cyclobutyl]methanamine is sourced from PubChem (CID 65194183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).