[1-[(5-chlorothiophen-2-yl)methyl]cyclopropyl]methanol

C9H11ClOS — CID 66025210

IUPAC[1-[(5-chlorothiophen-2-yl)methyl]cyclopropyl]methanol
SMILESOCC1(Cc2ccc(Cl)s2)CC1
InChIInChI=1S/C9H11ClOS/c10-8-2-1-7(12-8)5-9(6-11)3-4-9/h1-2,11H,3-6H2
InChIKeyHUFJUFBHPONXCX-UHFFFAOYSA-N
MW202.71 g/mol
LogP2.72
Rot. Bonds3

About [1-[(5-chlorothiophen-2-yl)methyl]cyclopropyl]methanol

[1-[(5-chlorothiophen-2-yl)methyl]cyclopropyl]methanol (PubChem CID 66025210) has the molecular formula C9H11ClOS and a molecular weight of 202.71 g/mol. Its IUPAC name is [1-[(5-chlorothiophen-2-yl)methyl]cyclopropyl]methanol.

Molecular Properties

Compound Name[1-[(5-chlorothiophen-2-yl)methyl]cyclopropyl]methanol
PubChem CID66025210
Molecular FormulaC9H11ClOS
Molecular Weight202.71 g/mol
Exact Mass202.02
IUPAC Name[1-[(5-chlorothiophen-2-yl)methyl]cyclopropyl]methanol
SMILESOCC1(Cc2ccc(Cl)s2)CC1
InChIInChI=1S/C9H11ClOS/c10-8-2-1-7(12-8)5-9(6-11)3-4-9/h1-2,11H,3-6H2
InChIKeyHUFJUFBHPONXCX-UHFFFAOYSA-N
XLogP2.72
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.71
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[3-[(5-chlorothiophen-2-yl)methyl]oxetan-3-yl]methanol
CID 116930330
1-[(5-chlorothiophen-2-yl)methyl]cycloheptan-1-ol
CID 65147193
2-[1-[[(5-chlorothiophen-2-yl)methylamino]methyl]cyclopropyl]ethanol
CID 114750264
3-[(5-chlorothiophen-2-yl)methyl]oxolan-3-ol
CID 65146101
[4-[(5-ethylthiophen-2-yl)methyl]oxan-4-yl]methanol
CID 66023872
[1-[(5-chlorothiophen-2-yl)methylamino]cyclopropyl]methanol
CID 115763041
3-(bromomethyl)-3-[(5-chlorothiophen-2-yl)methyl]oxane
CID 66042669
2-[(5-chlorothiophen-2-yl)methyl]thiolane-2-carboxylic acid
CID 83173851
[4-[(5-ethylthiophen-2-yl)methyl]piperidin-4-yl]methanol
CID 66024976
1-[(5-chlorothiophen-2-yl)methyl]-4-methylcyclohexane-1-carboxylic acid
CID 65393039
N-[[1-[(5-chlorothiophen-2-yl)methyl]cyclohexyl]methyl]propan-1-amine
CID 63507651
4-[(5-chlorothiophen-2-yl)methyl]azepan-4-ol
CID 103982903

Frequently Asked Questions

What is the IUPAC name of [1-[(5-chlorothiophen-2-yl)methyl]cyclopropyl]methanol?
The IUPAC name of [1-[(5-chlorothiophen-2-yl)methyl]cyclopropyl]methanol (CID 66025210) is [1-[(5-chlorothiophen-2-yl)methyl]cyclopropyl]methanol.
What is the SMILES notation for [1-[(5-chlorothiophen-2-yl)methyl]cyclopropyl]methanol?
The canonical SMILES for [1-[(5-chlorothiophen-2-yl)methyl]cyclopropyl]methanol is OCC1(Cc2ccc(Cl)s2)CC1.
What is the InChIKey of [1-[(5-chlorothiophen-2-yl)methyl]cyclopropyl]methanol?
The InChIKey is HUFJUFBHPONXCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11ClOS/c10-8-2-1-7(12-8)5-9(6-11)3-4-9/h1-2,11H,3-6H2.
What are the key properties of [1-[(5-chlorothiophen-2-yl)methyl]cyclopropyl]methanol?
[1-[(5-chlorothiophen-2-yl)methyl]cyclopropyl]methanol has a molecular weight of 202.71 g/mol, XLogP of 2.72, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(5-chlorothiophen-2-yl)methyl]cyclopropyl]methanol is sourced from PubChem (CID 66025210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).