[(1R,2R)-2-(5-bromothiophen-2-yl)cyclopropyl]methanol

C8H9BrOS — CID 155821129

IUPAC[(1R,2R)-2-(5-bromothiophen-2-yl)cyclopropyl]methanol
SMILESOC[C@@H]1C[C@H]1c1ccc(Br)s1
InChIInChI=1S/C8H9BrOS/c9-8-2-1-7(11-8)6-3-5(6)4-10/h1-2,5-6,10H,3-4H2/t5-,6+/m0/s1
InChIKeyHNGXFXAIUCCAMD-NTSWFWBYSA-N
MW233.13 g/mol
LogP2.61
Rot. Bonds2

About [(1R,2R)-2-(5-bromothiophen-2-yl)cyclopropyl]methanol

[(1R,2R)-2-(5-bromothiophen-2-yl)cyclopropyl]methanol (PubChem CID 155821129) has the molecular formula C8H9BrOS and a molecular weight of 233.13 g/mol. Its IUPAC name is [(1R,2R)-2-(5-bromothiophen-2-yl)cyclopropyl]methanol.

Molecular Properties

Compound Name[(1R,2R)-2-(5-bromothiophen-2-yl)cyclopropyl]methanol
PubChem CID155821129
Molecular FormulaC8H9BrOS
Molecular Weight233.13 g/mol
Exact Mass231.96
IUPAC Name[(1R,2R)-2-(5-bromothiophen-2-yl)cyclopropyl]methanol
SMILESOC[C@@H]1C[C@H]1c1ccc(Br)s1
InChIInChI=1S/C8H9BrOS/c9-8-2-1-7(11-8)6-3-5(6)4-10/h1-2,5-6,10H,3-4H2/t5-,6+/m0/s1
InChIKeyHNGXFXAIUCCAMD-NTSWFWBYSA-N
XLogP2.61
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.13
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [(1R,2R)-2-(5-bromothiophen-2-yl)cyclopropyl]methanol 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

rac-[(1R,2R)-2-(thiophen-2-yl)cyclopropyl]methanol
CID 67942345
3-Methyl-5-(2-thienyl)pentanol
CID 23272364
4-(5-Bromothiophen-2-yl)-2,2-difluorocyclopentan-1-ol
CID 137483472
(2S)-2-methyl-3-(5-methylthiophen-2-yl)propan-1-ol
CID 15156702
(2S)-3-(5-ethylthiophen-2-yl)-2-methylpropan-1-ol
CID 15156703
(2S)-2-methyl-3-(5-propylthiophen-2-yl)propan-1-ol
CID 15156704
(2S)-3-(5-butylthiophen-2-yl)-2-methylpropan-1-ol
CID 15156705
1-(5-Bromothiophen-2-yl)-2-ethylhexan-1-ol
CID 63427074
(2S)-2-methyl-4-thiophen-2-ylbutan-1-ol
CID 101701485
2-Bromo-3-(6-hydroxyhexyl)-5-iodothiophene
CID 102450706
2,4-Dimethyl-7-(thienyl-2)heptanol
CID 129805957
2-(Thiophen-2-ylmethyl)decan-1-ol
CID 162415958

Frequently Asked Questions

What is the IUPAC name of [(1R,2R)-2-(5-bromothiophen-2-yl)cyclopropyl]methanol?
The IUPAC name of [(1R,2R)-2-(5-bromothiophen-2-yl)cyclopropyl]methanol (CID 155821129) is [(1R,2R)-2-(5-bromothiophen-2-yl)cyclopropyl]methanol.
What is the SMILES notation for [(1R,2R)-2-(5-bromothiophen-2-yl)cyclopropyl]methanol?
The canonical SMILES for [(1R,2R)-2-(5-bromothiophen-2-yl)cyclopropyl]methanol is OC[C@@H]1C[C@H]1c1ccc(Br)s1.
What is the InChIKey of [(1R,2R)-2-(5-bromothiophen-2-yl)cyclopropyl]methanol?
The InChIKey is HNGXFXAIUCCAMD-NTSWFWBYSA-N. The full InChI is InChI=1S/C8H9BrOS/c9-8-2-1-7(11-8)6-3-5(6)4-10/h1-2,5-6,10H,3-4H2/t5-,6+/m0/s1.
What are the key properties of [(1R,2R)-2-(5-bromothiophen-2-yl)cyclopropyl]methanol?
[(1R,2R)-2-(5-bromothiophen-2-yl)cyclopropyl]methanol has a molecular weight of 233.13 g/mol, XLogP of 2.61, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R,2R)-2-(5-bromothiophen-2-yl)cyclopropyl]methanol is sourced from PubChem (CID 155821129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).