N-(2-pyrrolidin-1-ylethyl)thiophene-2-carboxamide;hydrochloride

C11H17ClN2OS — CID 2952427

IUPACN-(2-pyrrolidin-1-ylethyl)thiophene-2-carboxamide;hydrochloride
SMILESCl.O=C(NCCN1CCCC1)c1cccs1
InChIInChI=1S/C11H16N2OS.ClH/c14-11(10-4-3-9-15-10)12-5-8-13-6-1-2-7-13;/h3-4,9H,1-2,5-8H2,(H,12,14);1H
InChIKeyWMOJNOBQJLQMOJ-UHFFFAOYSA-N
MW260.79 g/mol
LogP2.00
Rot. Bonds4

About N-(2-pyrrolidin-1-ylethyl)thiophene-2-carboxamide;hydrochloride

N-(2-pyrrolidin-1-ylethyl)thiophene-2-carboxamide;hydrochloride (PubChem CID 2952427) has the molecular formula C11H17ClN2OS and a molecular weight of 260.79 g/mol. Its IUPAC name is N-(2-pyrrolidin-1-ylethyl)thiophene-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(2-pyrrolidin-1-ylethyl)thiophene-2-carboxamide;hydrochloride
PubChem CID2952427
Molecular FormulaC11H17ClN2OS
Molecular Weight260.79 g/mol
Exact Mass260.08
IUPAC NameN-(2-pyrrolidin-1-ylethyl)thiophene-2-carboxamide;hydrochloride
SMILESCl.O=C(NCCN1CCCC1)c1cccs1
InChIInChI=1S/C11H16N2OS.ClH/c14-11(10-4-3-9-15-10)12-5-8-13-6-1-2-7-13;/h3-4,9H,1-2,5-8H2,(H,12,14);1H
InChIKeyWMOJNOBQJLQMOJ-UHFFFAOYSA-N
XLogP2.00
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.79
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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N-[2-[4-(thiophene-3-carbonyl)piperazin-1-yl]ethyl]thiophene-2-carboxamide;hydrochloride
CID 71782823
N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]thiophene-2-carboxamide
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5-bromo-N-(2-pyrrolidin-1-ylethyl)thiophene-2-carboxamide
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CID 18571835
N-[3-oxo-3-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethylamino]propyl]thiophene-2-carboxamide
CID 55933196
N-[3-oxo-3-(3-piperazin-1-ylpropylamino)propyl]thiophene-2-carboxamide;hydrochloride
CID 119393805
N-(2-pyrrolidin-1-ylethyl)-2-(thiophen-2-ylmethyl)benzamide
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2-chloro-N-(2-pyrrolidin-1-ylethyl)benzamide;hydrochloride
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N-(2-aminoethyl)thiophene-2-carboxamide
CID 4649097
N-[2-(4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]decan-8-yl)ethyl]thiophene-2-carboxamide
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CID 25237516

Frequently Asked Questions

What is the IUPAC name of N-(2-pyrrolidin-1-ylethyl)thiophene-2-carboxamide;hydrochloride?
The IUPAC name of N-(2-pyrrolidin-1-ylethyl)thiophene-2-carboxamide;hydrochloride (CID 2952427) is N-(2-pyrrolidin-1-ylethyl)thiophene-2-carboxamide;hydrochloride.
What is the SMILES notation for N-(2-pyrrolidin-1-ylethyl)thiophene-2-carboxamide;hydrochloride?
The canonical SMILES for N-(2-pyrrolidin-1-ylethyl)thiophene-2-carboxamide;hydrochloride is Cl.O=C(NCCN1CCCC1)c1cccs1.
What is the InChIKey of N-(2-pyrrolidin-1-ylethyl)thiophene-2-carboxamide;hydrochloride?
The InChIKey is WMOJNOBQJLQMOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2OS.ClH/c14-11(10-4-3-9-15-10)12-5-8-13-6-1-2-7-13;/h3-4,9H,1-2,5-8H2,(H,12,14);1H.
What are the key properties of N-(2-pyrrolidin-1-ylethyl)thiophene-2-carboxamide;hydrochloride?
N-(2-pyrrolidin-1-ylethyl)thiophene-2-carboxamide;hydrochloride has a molecular weight of 260.79 g/mol, XLogP of 2.00, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-pyrrolidin-1-ylethyl)thiophene-2-carboxamide;hydrochloride is sourced from PubChem (CID 2952427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).