(5-methylthiophen-3-yl)-(4-propan-2-ylcyclohexyl)methanol

C15H24OS — CID 65425858

IUPAC(5-methylthiophen-3-yl)-(4-propan-2-ylcyclohexyl)methanol
SMILESCc1cc(C(O)C2CCC(C(C)C)CC2)cs1
InChIInChI=1S/C15H24OS/c1-10(2)12-4-6-13(7-5-12)15(16)14-8-11(3)17-9-14/h8-10,12-13,15-16H,4-7H2,1-3H3
InChIKeyHQNFYHQKFCDMIX-UHFFFAOYSA-N
MW252.42 g/mol
LogP4.55
Rot. Bonds3

About (5-methylthiophen-3-yl)-(4-propan-2-ylcyclohexyl)methanol

(5-methylthiophen-3-yl)-(4-propan-2-ylcyclohexyl)methanol (PubChem CID 65425858) has the molecular formula C15H24OS and a molecular weight of 252.42 g/mol. Its IUPAC name is (5-methylthiophen-3-yl)-(4-propan-2-ylcyclohexyl)methanol.

Molecular Properties

Compound Name(5-methylthiophen-3-yl)-(4-propan-2-ylcyclohexyl)methanol
PubChem CID65425858
Molecular FormulaC15H24OS
Molecular Weight252.42 g/mol
Exact Mass252.15
IUPAC Name(5-methylthiophen-3-yl)-(4-propan-2-ylcyclohexyl)methanol
SMILESCc1cc(C(O)C2CCC(C(C)C)CC2)cs1
InChIInChI=1S/C15H24OS/c1-10(2)12-4-6-13(7-5-12)15(16)14-8-11(3)17-9-14/h8-10,12-13,15-16H,4-7H2,1-3H3
InChIKeyHQNFYHQKFCDMIX-UHFFFAOYSA-N
XLogP4.55
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.42
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclopropyl-2-(5-methylthiophen-3-yl)ethane-1,2-diol
CID 103456956
(5-methylthiophen-3-yl)-[(3S)-pyrrolidin-3-yl]methanol
CID 164653665
cyclohex-3-en-1-yl-(5-methylthiophen-3-yl)methanol
CID 65100027
(1R)-1-(5-methylthiophen-3-yl)ethanol
CID 131209035
2-adamantyl-(5-methylthiophen-3-yl)methanol
CID 115807551
2-methyl-1-(5-methylthiophen-3-yl)propan-1-ol
CID 65099385
(1S,2R)-1-amino-1-(5-methylthiophen-3-yl)propan-2-ol
CID 55293890
(4-fluoro-3-methylphenyl)-(4-propan-2-ylcyclohexyl)methanol
CID 65424893
2-cyclopropyl-1-(5-methylthiophen-3-yl)ethanamine
CID 55294440
cyclopropyl-(2,6-dimethyl-4-pyridinyl)methanol
CID 107502834
1-(5-methylthiophen-3-yl)-4-propan-2-ylcyclohexan-1-amine
CID 65099403
(4-methylmorpholin-2-yl)-(5-methylthiophen-3-yl)methanol
CID 79087568

Frequently Asked Questions

What is the IUPAC name of (5-methylthiophen-3-yl)-(4-propan-2-ylcyclohexyl)methanol?
The IUPAC name of (5-methylthiophen-3-yl)-(4-propan-2-ylcyclohexyl)methanol (CID 65425858) is (5-methylthiophen-3-yl)-(4-propan-2-ylcyclohexyl)methanol.
What is the SMILES notation for (5-methylthiophen-3-yl)-(4-propan-2-ylcyclohexyl)methanol?
The canonical SMILES for (5-methylthiophen-3-yl)-(4-propan-2-ylcyclohexyl)methanol is Cc1cc(C(O)C2CCC(C(C)C)CC2)cs1.
What is the InChIKey of (5-methylthiophen-3-yl)-(4-propan-2-ylcyclohexyl)methanol?
The InChIKey is HQNFYHQKFCDMIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24OS/c1-10(2)12-4-6-13(7-5-12)15(16)14-8-11(3)17-9-14/h8-10,12-13,15-16H,4-7H2,1-3H3.
What are the key properties of (5-methylthiophen-3-yl)-(4-propan-2-ylcyclohexyl)methanol?
(5-methylthiophen-3-yl)-(4-propan-2-ylcyclohexyl)methanol has a molecular weight of 252.42 g/mol, XLogP of 4.55, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methylthiophen-3-yl)-(4-propan-2-ylcyclohexyl)methanol is sourced from PubChem (CID 65425858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).