5-chloro-N-(2-methylpiperidin-3-yl)thiophene-2-carboxamide

C11H15ClN2OS — CID 114695049

IUPAC5-chloro-N-(2-methylpiperidin-3-yl)thiophene-2-carboxamide
SMILESCC1NCCCC1NC(=O)c1ccc(Cl)s1
InChIInChI=1S/C11H15ClN2OS/c1-7-8(3-2-6-13-7)14-11(15)9-4-5-10(12)16-9/h4-5,7-8,13H,2-3,6H2,1H3,(H,14,15)
InChIKeyONQFMUYODHWVPQ-UHFFFAOYSA-N
MW258.77 g/mol
LogP2.27
Rot. Bonds2

About 5-chloro-N-(2-methylpiperidin-3-yl)thiophene-2-carboxamide

5-chloro-N-(2-methylpiperidin-3-yl)thiophene-2-carboxamide (PubChem CID 114695049) has the molecular formula C11H15ClN2OS and a molecular weight of 258.77 g/mol. Its IUPAC name is 5-chloro-N-(2-methylpiperidin-3-yl)thiophene-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-(2-methylpiperidin-3-yl)thiophene-2-carboxamide
PubChem CID114695049
Molecular FormulaC11H15ClN2OS
Molecular Weight258.77 g/mol
Exact Mass258.06
IUPAC Name5-chloro-N-(2-methylpiperidin-3-yl)thiophene-2-carboxamide
SMILESCC1NCCCC1NC(=O)c1ccc(Cl)s1
InChIInChI=1S/C11H15ClN2OS/c1-7-8(3-2-6-13-7)14-11(15)9-4-5-10(12)16-9/h4-5,7-8,13H,2-3,6H2,1H3,(H,14,15)
InChIKeyONQFMUYODHWVPQ-UHFFFAOYSA-N
XLogP2.27
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.77
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2,5-dichloro-N-(2-methylpiperidin-3-yl)thiophene-3-carboxamide
CID 106813442
3-(5-chlorothiophen-2-yl)-N-(2-methylpiperidin-3-yl)propanamide
CID 120576515
2-(5-chlorothiophen-2-yl)-N-(2-methylpiperidin-3-yl)-1,3-thiazole-4-carboxamide
CID 120574509
5-chloro-N-(2-chlorocyclohexyl)thiophene-2-carboxamide
CID 114301266
3-(5-chlorothiophen-2-yl)-N-(2-methylpiperidin-3-yl)propanamide;hydrochloride
CID 120576514
N-(2-methylpiperidin-3-yl)-5,6-dihydro-4H-cyclopenta[b]thiophene-2-carboxamide
CID 114694841
N-[(2R,3R)-2-methylpiperidin-3-yl]benzamide
CID 124511336
N-(azepan-4-yl)-5-chlorothiophene-2-carboxamide
CID 105058867
5-chloro-N-[(3R)-2-oxopiperidin-3-yl]thiophene-2-carboxamide
CID 95048356
5-chloro-N-[4-(methylamino)cyclohexyl]thiophene-2-carboxamide
CID 79110894
3-chloro-2-methyl-N-(2-methylpiperidin-3-yl)benzamide
CID 107098369
2-bromo-4-chloro-N-(2-methylpiperidin-3-yl)benzamide
CID 106813439

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(2-methylpiperidin-3-yl)thiophene-2-carboxamide?
The IUPAC name of 5-chloro-N-(2-methylpiperidin-3-yl)thiophene-2-carboxamide (CID 114695049) is 5-chloro-N-(2-methylpiperidin-3-yl)thiophene-2-carboxamide.
What is the SMILES notation for 5-chloro-N-(2-methylpiperidin-3-yl)thiophene-2-carboxamide?
The canonical SMILES for 5-chloro-N-(2-methylpiperidin-3-yl)thiophene-2-carboxamide is CC1NCCCC1NC(=O)c1ccc(Cl)s1.
What is the InChIKey of 5-chloro-N-(2-methylpiperidin-3-yl)thiophene-2-carboxamide?
The InChIKey is ONQFMUYODHWVPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClN2OS/c1-7-8(3-2-6-13-7)14-11(15)9-4-5-10(12)16-9/h4-5,7-8,13H,2-3,6H2,1H3,(H,14,15).
What are the key properties of 5-chloro-N-(2-methylpiperidin-3-yl)thiophene-2-carboxamide?
5-chloro-N-(2-methylpiperidin-3-yl)thiophene-2-carboxamide has a molecular weight of 258.77 g/mol, XLogP of 2.27, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2-methylpiperidin-3-yl)thiophene-2-carboxamide is sourced from PubChem (CID 114695049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).