(2-methylpiperidin-2-yl)-thiophen-2-ylmethanone

C11H15NOS — CID 116614225

IUPAC(2-methylpiperidin-2-yl)-thiophen-2-ylmethanone
SMILESCC1(C(=O)c2cccs2)CCCCN1
InChIInChI=1S/C11H15NOS/c1-11(6-2-3-7-12-11)10(13)9-5-4-8-14-9/h4-5,8,12H,2-3,6-7H2,1H3
InChIKeyMLTNVGWFUGSNCO-UHFFFAOYSA-N
MW209.31 g/mol
LogP2.46
Rot. Bonds2

About (2-methylpiperidin-2-yl)-thiophen-2-ylmethanone

(2-methylpiperidin-2-yl)-thiophen-2-ylmethanone (PubChem CID 116614225) has the molecular formula C11H15NOS and a molecular weight of 209.31 g/mol. Its IUPAC name is (2-methylpiperidin-2-yl)-thiophen-2-ylmethanone.

Molecular Properties

Compound Name(2-methylpiperidin-2-yl)-thiophen-2-ylmethanone
PubChem CID116614225
Molecular FormulaC11H15NOS
Molecular Weight209.31 g/mol
Exact Mass209.09
IUPAC Name(2-methylpiperidin-2-yl)-thiophen-2-ylmethanone
SMILESCC1(C(=O)c2cccs2)CCCCN1
InChIInChI=1S/C11H15NOS/c1-11(6-2-3-7-12-11)10(13)9-5-4-8-14-9/h4-5,8,12H,2-3,6-7H2,1H3
InChIKeyMLTNVGWFUGSNCO-UHFFFAOYSA-N
XLogP2.46
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.31
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,2-dimethyl-N-(thiophen-2-ylmethyl)piperidine-2-carboxamide
CID 113368557
[1-(dimethylamino)cyclopentyl]-thiophen-2-ylmethanone
CID 79067610
(2-chlorophenyl)-(2-methylpiperidin-2-yl)methanone
CID 116613964
(3,5-dimethylphenyl)-(2-methylpiperidin-2-yl)methanone
CID 116613962
(3-bromothiophen-2-yl)-(2-methylpyrrolidin-2-yl)methanone
CID 116580442
3-[(2-methylpiperidine-2-carbonyl)amino]-3-thiophen-2-ylpropanoic acid
CID 104596315
(1-methoxycycloheptyl)-thiophen-2-ylmethanone
CID 116750550
[4-fluoro-3-(trifluoromethyl)phenyl]-(2-methylpiperidin-2-yl)methanone
CID 107291162
(2-methylpiperidin-2-yl)-(2-thiophen-2-ylpyrrolidin-1-yl)methanone
CID 104596359
(4-fluorophenyl)-(2-methylpyrrolidin-2-yl)methanone
CID 116580446
2-methyl-2-thiophen-2-ylpiperidine
CID 83530082
(1-methoxycyclobutyl)-thiophen-2-ylmethanone
CID 116707010

Frequently Asked Questions

What is the IUPAC name of (2-methylpiperidin-2-yl)-thiophen-2-ylmethanone?
The IUPAC name of (2-methylpiperidin-2-yl)-thiophen-2-ylmethanone (CID 116614225) is (2-methylpiperidin-2-yl)-thiophen-2-ylmethanone.
What is the SMILES notation for (2-methylpiperidin-2-yl)-thiophen-2-ylmethanone?
The canonical SMILES for (2-methylpiperidin-2-yl)-thiophen-2-ylmethanone is CC1(C(=O)c2cccs2)CCCCN1.
What is the InChIKey of (2-methylpiperidin-2-yl)-thiophen-2-ylmethanone?
The InChIKey is MLTNVGWFUGSNCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NOS/c1-11(6-2-3-7-12-11)10(13)9-5-4-8-14-9/h4-5,8,12H,2-3,6-7H2,1H3.
What are the key properties of (2-methylpiperidin-2-yl)-thiophen-2-ylmethanone?
(2-methylpiperidin-2-yl)-thiophen-2-ylmethanone has a molecular weight of 209.31 g/mol, XLogP of 2.46, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylpiperidin-2-yl)-thiophen-2-ylmethanone is sourced from PubChem (CID 116614225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).