N-methyl-N-(thiophen-2-ylmethyl)pyrrolidine-2-carboxamide;hydrochloride

C11H17ClN2OS — CID 119267121

IUPACN-methyl-N-(thiophen-2-ylmethyl)pyrrolidine-2-carboxamide;hydrochloride
SMILESCN(Cc1cccs1)C(=O)C1CCCN1.Cl
InChIInChI=1S/C11H16N2OS.ClH/c1-13(8-9-4-3-7-15-9)11(14)10-5-2-6-12-10;/h3-4,7,10,12H,2,5-6,8H2,1H3;1H
InChIKeyXOUHAYADOCQHJT-UHFFFAOYSA-N
MW260.79 g/mol
LogP1.88
Rot. Bonds3

About N-methyl-N-(thiophen-2-ylmethyl)pyrrolidine-2-carboxamide;hydrochloride

N-methyl-N-(thiophen-2-ylmethyl)pyrrolidine-2-carboxamide;hydrochloride (PubChem CID 119267121) has the molecular formula C11H17ClN2OS and a molecular weight of 260.79 g/mol. Its IUPAC name is N-methyl-N-(thiophen-2-ylmethyl)pyrrolidine-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-methyl-N-(thiophen-2-ylmethyl)pyrrolidine-2-carboxamide;hydrochloride
PubChem CID119267121
Molecular FormulaC11H17ClN2OS
Molecular Weight260.79 g/mol
Exact Mass260.08
IUPAC NameN-methyl-N-(thiophen-2-ylmethyl)pyrrolidine-2-carboxamide;hydrochloride
SMILESCN(Cc1cccs1)C(=O)C1CCCN1.Cl
InChIInChI=1S/C11H16N2OS.ClH/c1-13(8-9-4-3-7-15-9)11(14)10-5-2-6-12-10;/h3-4,7,10,12H,2,5-6,8H2,1H3;1H
InChIKeyXOUHAYADOCQHJT-UHFFFAOYSA-N
XLogP1.88
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.79
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 64563589
N-cyclopropyl-N-(thiophen-2-ylmethyl)pyrrolidine-2-carboxamide
CID 54870571
N-methyl-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]pyrrolidine-2-carboxamide
CID 119324788
N,N-bis(thiophen-2-ylmethyl)piperidine-2-carboxamide
CID 60936813
N-[(4-bromothiophen-2-yl)methyl]-N-methylpyrrolidine-2-carboxamide;hydrochloride
CID 119293813
N-methyl-N-(thiophen-2-ylmethyl)piperidine-4-carboxamide;hydrochloride
CID 119267119
(2S)-N-[(4-bromothiophen-2-yl)methyl]-N-methylpyrrolidine-2-carboxamide
CID 61162812
(2S)-N-benzyl-N-methylpyrrolidine-2-carboxamide
CID 22691346
N,2-dimethyl-N-(thiophen-2-ylmethyl)pyrrolidine-3-carboxamide
CID 79388890
(2S)-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrrolidine-2-carboxamide;dihydrochloride
CID 119859306
(3S)-N-methyl-N-(thiophen-2-ylmethyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
CID 104896139
(2S)-N-[(4-ethylphenyl)methyl]-N-methylpyrrolidine-2-carboxamide;hydrochloride
CID 119266906

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(thiophen-2-ylmethyl)pyrrolidine-2-carboxamide;hydrochloride?
The IUPAC name of N-methyl-N-(thiophen-2-ylmethyl)pyrrolidine-2-carboxamide;hydrochloride (CID 119267121) is N-methyl-N-(thiophen-2-ylmethyl)pyrrolidine-2-carboxamide;hydrochloride.
What is the SMILES notation for N-methyl-N-(thiophen-2-ylmethyl)pyrrolidine-2-carboxamide;hydrochloride?
The canonical SMILES for N-methyl-N-(thiophen-2-ylmethyl)pyrrolidine-2-carboxamide;hydrochloride is CN(Cc1cccs1)C(=O)C1CCCN1.Cl.
What is the InChIKey of N-methyl-N-(thiophen-2-ylmethyl)pyrrolidine-2-carboxamide;hydrochloride?
The InChIKey is XOUHAYADOCQHJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2OS.ClH/c1-13(8-9-4-3-7-15-9)11(14)10-5-2-6-12-10;/h3-4,7,10,12H,2,5-6,8H2,1H3;1H.
What are the key properties of N-methyl-N-(thiophen-2-ylmethyl)pyrrolidine-2-carboxamide;hydrochloride?
N-methyl-N-(thiophen-2-ylmethyl)pyrrolidine-2-carboxamide;hydrochloride has a molecular weight of 260.79 g/mol, XLogP of 1.88, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(thiophen-2-ylmethyl)pyrrolidine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119267121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).