2-[1-(2-methylpropyl)cyclohexyl]thiophene

C14H22S — CID 121406244

IUPAC2-[1-(2-methylpropyl)cyclohexyl]thiophene
SMILESCC(C)CC1(c2cccs2)CCCCC1
InChIInChI=1S/C14H22S/c1-12(2)11-14(8-4-3-5-9-14)13-7-6-10-15-13/h6-7,10,12H,3-5,8-9,11H2,1-2H3
InChIKeyFEFHLSKWWXXXLK-UHFFFAOYSA-N
MW222.40 g/mol
LogP5.00
Rot. Bonds3

About 2-[1-(2-methylpropyl)cyclohexyl]thiophene

2-[1-(2-methylpropyl)cyclohexyl]thiophene (PubChem CID 121406244) has the molecular formula C14H22S and a molecular weight of 222.40 g/mol. Its IUPAC name is 2-[1-(2-methylpropyl)cyclohexyl]thiophene.

Molecular Properties

Compound Name2-[1-(2-methylpropyl)cyclohexyl]thiophene
PubChem CID121406244
Molecular FormulaC14H22S
Molecular Weight222.40 g/mol
Exact Mass222.14
IUPAC Name2-[1-(2-methylpropyl)cyclohexyl]thiophene
SMILESCC(C)CC1(c2cccs2)CCCCC1
InChIInChI=1S/C14H22S/c1-12(2)11-14(8-4-3-5-9-14)13-7-6-10-15-13/h6-7,10,12H,3-5,8-9,11H2,1-2H3
InChIKeyFEFHLSKWWXXXLK-UHFFFAOYSA-N
XLogP5.00
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.40
LogP ≤ 55.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(1-thiophen-2-ylcycloheptyl)methyl]propan-2-amine
CID 55095998
N-propan-2-yl-1-thiophen-2-ylcyclohexan-1-amine
CID 146535079
(2R)-2-amino-N-[(1-thiophen-2-ylcyclohexyl)methyl]propanamide
CID 119332541
(1-thiophen-2-ylcyclobutyl)methanol
CID 83682682
N-[(1-thiophen-2-ylcyclohexyl)methyl]cyclopropanamine
CID 62595162
N-methyl-1-(1-thiophen-2-ylcyclohexyl)ethanamine
CID 68673941
2-[1-(isothiocyanatomethyl)cyclopentyl]thiophene
CID 23348537
N-[(4-thiophen-2-yloxan-4-yl)methyl]propan-2-amine
CID 62594784
2,3,4,5,6-pentamethyl-N-[(1-thiophen-2-ylcyclohexyl)methyl]benzenesulfonamide
CID 30943352
1-thiophen-2-ylcycloheptan-1-ol
CID 61103027
N-[(3,3-dimethyl-1-thiophen-2-ylcyclobutyl)methyl]propan-2-amine
CID 64997430
(2S)-N-(methylcarbamoyl)-2-[(1-thiophen-2-ylcyclopentyl)methylamino]propanamide
CID 95156564

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-methylpropyl)cyclohexyl]thiophene?
The IUPAC name of 2-[1-(2-methylpropyl)cyclohexyl]thiophene (CID 121406244) is 2-[1-(2-methylpropyl)cyclohexyl]thiophene.
What is the SMILES notation for 2-[1-(2-methylpropyl)cyclohexyl]thiophene?
The canonical SMILES for 2-[1-(2-methylpropyl)cyclohexyl]thiophene is CC(C)CC1(c2cccs2)CCCCC1.
What is the InChIKey of 2-[1-(2-methylpropyl)cyclohexyl]thiophene?
The InChIKey is FEFHLSKWWXXXLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22S/c1-12(2)11-14(8-4-3-5-9-14)13-7-6-10-15-13/h6-7,10,12H,3-5,8-9,11H2,1-2H3.
What are the key properties of 2-[1-(2-methylpropyl)cyclohexyl]thiophene?
2-[1-(2-methylpropyl)cyclohexyl]thiophene has a molecular weight of 222.40 g/mol, XLogP of 5.00, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-methylpropyl)cyclohexyl]thiophene is sourced from PubChem (CID 121406244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).