(1-thiophen-2-ylcyclobutyl)methanol

C9H12OS — CID 83682682

IUPAC(1-thiophen-2-ylcyclobutyl)methanol
SMILESOCC1(c2cccs2)CCC1
InChIInChI=1S/C9H12OS/c10-7-9(4-2-5-9)8-3-1-6-11-8/h1,3,6,10H,2,4-5,7H2
InChIKeyHQWPCZWFZHAKIU-UHFFFAOYSA-N
MW168.26 g/mol
LogP2.16
Rot. Bonds2

About (1-thiophen-2-ylcyclobutyl)methanol

(1-thiophen-2-ylcyclobutyl)methanol (PubChem CID 83682682) has the molecular formula C9H12OS and a molecular weight of 168.26 g/mol. Its IUPAC name is (1-thiophen-2-ylcyclobutyl)methanol.

Molecular Properties

Compound Name(1-thiophen-2-ylcyclobutyl)methanol
PubChem CID83682682
Molecular FormulaC9H12OS
Molecular Weight168.26 g/mol
Exact Mass168.06
IUPAC Name(1-thiophen-2-ylcyclobutyl)methanol
SMILESOCC1(c2cccs2)CCC1
InChIInChI=1S/C9H12OS/c10-7-9(4-2-5-9)8-3-1-6-11-8/h1,3,6,10H,2,4-5,7H2
InChIKeyHQWPCZWFZHAKIU-UHFFFAOYSA-N
XLogP2.16
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.26
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1-thiophen-2-ylcyclobutyl)methyl]cyclopropanamine
CID 62595338
N-[(1-thiophen-2-ylcyclohexyl)methyl]cyclopropanamine
CID 62595162
N-[(1-thiophen-2-ylcycloheptyl)methyl]propan-2-amine
CID 55095998
2-[1-(2-methylpropyl)cyclohexyl]thiophene
CID 121406244
2-[1-(isothiocyanatomethyl)cyclopentyl]thiophene
CID 23348537
1-cyclohexyl-3-[(1-thiophen-2-ylcyclopropyl)methyl]urea
CID 30522444
1-(4-hydroxycyclohexyl)-3-[(1-thiophen-2-ylcyclohexyl)methyl]urea
CID 111440825
(2R)-2-amino-N-[(1-thiophen-2-ylcyclohexyl)methyl]propanamide
CID 119332541
1-thiophen-2-ylcycloheptan-1-ol
CID 61103027
3-[[(1-thiophen-2-ylcyclohexyl)methylamino]methyl]benzoic acid
CID 122031530
3-thiophen-2-yl-N-[(1-thiophen-2-ylcyclopentyl)methyl]prop-2-enamide
CID 71960903
methyl N-[(1-thiophen-2-ylcyclopropyl)methyl]carbamate
CID 30522713

Frequently Asked Questions

What is the IUPAC name of (1-thiophen-2-ylcyclobutyl)methanol?
The IUPAC name of (1-thiophen-2-ylcyclobutyl)methanol (CID 83682682) is (1-thiophen-2-ylcyclobutyl)methanol.
What is the SMILES notation for (1-thiophen-2-ylcyclobutyl)methanol?
The canonical SMILES for (1-thiophen-2-ylcyclobutyl)methanol is OCC1(c2cccs2)CCC1.
What is the InChIKey of (1-thiophen-2-ylcyclobutyl)methanol?
The InChIKey is HQWPCZWFZHAKIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12OS/c10-7-9(4-2-5-9)8-3-1-6-11-8/h1,3,6,10H,2,4-5,7H2.
What are the key properties of (1-thiophen-2-ylcyclobutyl)methanol?
(1-thiophen-2-ylcyclobutyl)methanol has a molecular weight of 168.26 g/mol, XLogP of 2.16, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-thiophen-2-ylcyclobutyl)methanol is sourced from PubChem (CID 83682682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).