1-(2-methyl-2,3-dihydrothiophen-5-yl)piperidine

C10H17NS — CID 89399017

IUPAC1-(2-methyl-2,3-dihydrothiophen-5-yl)piperidine
SMILESCC1CC=C(N2CCCCC2)S1
InChIInChI=1S/C10H17NS/c1-9-5-6-10(12-9)11-7-3-2-4-8-11/h6,9H,2-5,7-8H2,1H3
InChIKeyHDQDWKLQUPWBKQ-UHFFFAOYSA-N
MW183.32 g/mol
LogP2.84
Rot. Bonds1

About 1-(2-methyl-2,3-dihydrothiophen-5-yl)piperidine

1-(2-methyl-2,3-dihydrothiophen-5-yl)piperidine (PubChem CID 89399017) has the molecular formula C10H17NS and a molecular weight of 183.32 g/mol. Its IUPAC name is 1-(2-methyl-2,3-dihydrothiophen-5-yl)piperidine.

Molecular Properties

Compound Name1-(2-methyl-2,3-dihydrothiophen-5-yl)piperidine
PubChem CID89399017
Molecular FormulaC10H17NS
Molecular Weight183.32 g/mol
Exact Mass183.11
IUPAC Name1-(2-methyl-2,3-dihydrothiophen-5-yl)piperidine
SMILESCC1CC=C(N2CCCCC2)S1
InChIInChI=1S/C10H17NS/c1-9-5-6-10(12-9)11-7-3-2-4-8-11/h6,9H,2-5,7-8H2,1H3
InChIKeyHDQDWKLQUPWBKQ-UHFFFAOYSA-N
XLogP2.84
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.32
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-methyl-2-piperidin-1-ylcyclopent-2-ene-1-carbaldehyde
CID 174433298
4-(3,6-dimethylcyclohexa-1,5-dien-1-yl)-2-piperidin-1-ylpyridine
CID 134379256
1-[2,6-di(propan-2-yl)phenyl]piperidine
CID 10634131
1,16-diazatricyclo[14.14.4.231,34]hexatriaconta-31,33,35-triene
CID 177496449
1-(2-methoxy-3,6-dihydro-2H-pyran-5-yl)piperidine
CID 14708179
1-(4-iodocyclohexa-1,5-dien-1-yl)piperidine
CID 67558212
methylcyclohexane;1-phenylpiperidine
CID 174582589
(5S)-5-methyl-2-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]-4,5-dihydro-1,3-thiazole
CID 125138758
(5-methyl-8-azabicyclo[5.2.0]nona-1,6-dien-8-yl)-pyrrolidin-1-ylmethanone
CID 142032547
40,41-dimethyl-1,20-diazatricyclo[18.18.4.239,42]tetratetraconta-39,41,43-triene
CID 177473830
2-(azepan-1-yl)-6-ethyl-5-phenyl-6H-1,3,4-thiadiazine
CID 2865629
4-(4-methylpiperidin-1-yl)-6-piperidin-1-ylpyrimidine
CID 112856002

Frequently Asked Questions

What is the IUPAC name of 1-(2-methyl-2,3-dihydrothiophen-5-yl)piperidine?
The IUPAC name of 1-(2-methyl-2,3-dihydrothiophen-5-yl)piperidine (CID 89399017) is 1-(2-methyl-2,3-dihydrothiophen-5-yl)piperidine.
What is the SMILES notation for 1-(2-methyl-2,3-dihydrothiophen-5-yl)piperidine?
The canonical SMILES for 1-(2-methyl-2,3-dihydrothiophen-5-yl)piperidine is CC1CC=C(N2CCCCC2)S1.
What is the InChIKey of 1-(2-methyl-2,3-dihydrothiophen-5-yl)piperidine?
The InChIKey is HDQDWKLQUPWBKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NS/c1-9-5-6-10(12-9)11-7-3-2-4-8-11/h6,9H,2-5,7-8H2,1H3.
What are the key properties of 1-(2-methyl-2,3-dihydrothiophen-5-yl)piperidine?
1-(2-methyl-2,3-dihydrothiophen-5-yl)piperidine has a molecular weight of 183.32 g/mol, XLogP of 2.84, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methyl-2,3-dihydrothiophen-5-yl)piperidine is sourced from PubChem (CID 89399017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).