3-methyl-1-(2-methyl-1-thiophen-2-ylcyclohexyl)piperidine

C17H27NS — CID 10707699

IUPAC3-methyl-1-(2-methyl-1-thiophen-2-ylcyclohexyl)piperidine
SMILESCC1CCCN(C2(c3cccs3)CCCCC2C)C1
InChIInChI=1S/C17H27NS/c1-14-7-5-11-18(13-14)17(16-9-6-12-19-16)10-4-3-8-15(17)2/h6,9,12,14-15H,3-5,7-8,10-11,13H2,1-2H3
InChIKeyBBFINCSTQNQPET-UHFFFAOYSA-N
MW277.48 g/mol
LogP4.89
Rot. Bonds2

About 3-methyl-1-(2-methyl-1-thiophen-2-ylcyclohexyl)piperidine

3-methyl-1-(2-methyl-1-thiophen-2-ylcyclohexyl)piperidine (PubChem CID 10707699) has the molecular formula C17H27NS and a molecular weight of 277.48 g/mol. Its IUPAC name is 3-methyl-1-(2-methyl-1-thiophen-2-ylcyclohexyl)piperidine.

Molecular Properties

Compound Name3-methyl-1-(2-methyl-1-thiophen-2-ylcyclohexyl)piperidine
PubChem CID10707699
Molecular FormulaC17H27NS
Molecular Weight277.48 g/mol
Exact Mass277.19
IUPAC Name3-methyl-1-(2-methyl-1-thiophen-2-ylcyclohexyl)piperidine
SMILESCC1CCCN(C2(c3cccs3)CCCCC2C)C1
InChIInChI=1S/C17H27NS/c1-14-7-5-11-18(13-14)17(16-9-6-12-19-16)10-4-3-8-15(17)2/h6,9,12,14-15H,3-5,7-8,10-11,13H2,1-2H3
InChIKeyBBFINCSTQNQPET-UHFFFAOYSA-N
XLogP4.89
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.48
LogP ≤ 54.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(3S)-3-methyl-1-[(1S,2R)-2-methyl-1-thiophen-2-ylcyclohexyl]piperidine
CID 10731255
(3R)-3-methyl-1-[(1S,2S)-2-methyl-1-thiophen-2-ylcyclohexyl]piperidine
CID 10660186
(6E,10E,14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene;1-[(1R,2S)-2-methyl-1-thiophen-2-ylcyclohexyl]piperidine
CID 44537953
[(1R,2S)-2-piperidin-1-yl-2-thiophen-2-ylcyclohexyl]methanol
CID 15103557
(2-piperidin-1-yl-2-thiophen-2-ylcyclohexyl)methanol
CID 164513072
1-[(1S,2R)-2-prop-2-enyl-1-thiophen-2-ylcyclohexyl]piperidine
CID 67624546
(4-methylpiperidin-1-yl)-(1-thiophen-2-ylcyclopentyl)methanone
CID 42435504
1,2-dimethyl-1-[(1R,2S)-2-methyl-1-thiophen-2-ylcyclohexyl]piperidin-1-ium
CID 118218593
1,3-dimethyl-4-thiophen-2-ylpiperidin-4-ol
CID 130834241
(3-aminopiperidin-1-yl)-(1-thiophen-2-ylcyclohexyl)methanone
CID 119380014
2-(3-methylpiperidin-1-yl)-2-phenylcyclohexan-1-one
CID 156552583
3-methyl-1-thiophen-2-ylcyclopentan-1-ol
CID 64513369

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-(2-methyl-1-thiophen-2-ylcyclohexyl)piperidine?
The IUPAC name of 3-methyl-1-(2-methyl-1-thiophen-2-ylcyclohexyl)piperidine (CID 10707699) is 3-methyl-1-(2-methyl-1-thiophen-2-ylcyclohexyl)piperidine.
What is the SMILES notation for 3-methyl-1-(2-methyl-1-thiophen-2-ylcyclohexyl)piperidine?
The canonical SMILES for 3-methyl-1-(2-methyl-1-thiophen-2-ylcyclohexyl)piperidine is CC1CCCN(C2(c3cccs3)CCCCC2C)C1.
What is the InChIKey of 3-methyl-1-(2-methyl-1-thiophen-2-ylcyclohexyl)piperidine?
The InChIKey is BBFINCSTQNQPET-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27NS/c1-14-7-5-11-18(13-14)17(16-9-6-12-19-16)10-4-3-8-15(17)2/h6,9,12,14-15H,3-5,7-8,10-11,13H2,1-2H3.
What are the key properties of 3-methyl-1-(2-methyl-1-thiophen-2-ylcyclohexyl)piperidine?
3-methyl-1-(2-methyl-1-thiophen-2-ylcyclohexyl)piperidine has a molecular weight of 277.48 g/mol, XLogP of 4.89, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-(2-methyl-1-thiophen-2-ylcyclohexyl)piperidine is sourced from PubChem (CID 10707699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).