[1-(ethylsulfanylmethyl)cyclopropyl]methanol

C7H14OS — CID 67692203

IUPAC[1-(ethylsulfanylmethyl)cyclopropyl]methanol
SMILESCCSCC1(CO)CC1
InChIInChI=1S/C7H14OS/c1-2-9-6-7(5-8)3-4-7/h8H,2-6H2,1H3
InChIKeyNIBVTTAHJOEDSF-UHFFFAOYSA-N
MW146.25 g/mol
LogP1.51
Rot. Bonds4

About [1-(ethylsulfanylmethyl)cyclopropyl]methanol

[1-(ethylsulfanylmethyl)cyclopropyl]methanol (PubChem CID 67692203) has the molecular formula C7H14OS and a molecular weight of 146.25 g/mol. Its IUPAC name is [1-(ethylsulfanylmethyl)cyclopropyl]methanol.

Molecular Properties

Compound Name[1-(ethylsulfanylmethyl)cyclopropyl]methanol
PubChem CID67692203
Molecular FormulaC7H14OS
Molecular Weight146.25 g/mol
Exact Mass146.08
IUPAC Name[1-(ethylsulfanylmethyl)cyclopropyl]methanol
SMILESCCSCC1(CO)CC1
InChIInChI=1S/C7H14OS/c1-2-9-6-7(5-8)3-4-7/h8H,2-6H2,1H3
InChIKeyNIBVTTAHJOEDSF-UHFFFAOYSA-N
XLogP1.51
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.25
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [1-(ethylsulfanylmethyl)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

Frequently Asked Questions

What is the IUPAC name of [1-(ethylsulfanylmethyl)cyclopropyl]methanol?
The IUPAC name of [1-(ethylsulfanylmethyl)cyclopropyl]methanol (CID 67692203) is [1-(ethylsulfanylmethyl)cyclopropyl]methanol.
What is the SMILES notation for [1-(ethylsulfanylmethyl)cyclopropyl]methanol?
The canonical SMILES for [1-(ethylsulfanylmethyl)cyclopropyl]methanol is CCSCC1(CO)CC1.
What is the InChIKey of [1-(ethylsulfanylmethyl)cyclopropyl]methanol?
The InChIKey is NIBVTTAHJOEDSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14OS/c1-2-9-6-7(5-8)3-4-7/h8H,2-6H2,1H3.
What are the key properties of [1-(ethylsulfanylmethyl)cyclopropyl]methanol?
[1-(ethylsulfanylmethyl)cyclopropyl]methanol has a molecular weight of 146.25 g/mol, XLogP of 1.51, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(ethylsulfanylmethyl)cyclopropyl]methanol is sourced from PubChem (CID 67692203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).