3-amino-N-methyl-N-(2-thiophen-2-ylethyl)cyclopentane-1-carboxamide;hydrochloride

C13H21ClN2OS — CID 119807064

IUPAC3-amino-N-methyl-N-(2-thiophen-2-ylethyl)cyclopentane-1-carboxamide;hydrochloride
SMILESCN(CCc1cccs1)C(=O)C1CCC(N)C1.Cl
InChIInChI=1S/C13H20N2OS.ClH/c1-15(7-6-12-3-2-8-17-12)13(16)10-4-5-11(14)9-10;/h2-3,8,10-11H,4-7,9,14H2,1H3;1H
InChIKeyHVCVRFOVSBVHIR-UHFFFAOYSA-N
MW288.84 g/mol
LogP2.30
Rot. Bonds4

About 3-amino-N-methyl-N-(2-thiophen-2-ylethyl)cyclopentane-1-carboxamide;hydrochloride

3-amino-N-methyl-N-(2-thiophen-2-ylethyl)cyclopentane-1-carboxamide;hydrochloride (PubChem CID 119807064) has the molecular formula C13H21ClN2OS and a molecular weight of 288.84 g/mol. Its IUPAC name is 3-amino-N-methyl-N-(2-thiophen-2-ylethyl)cyclopentane-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name3-amino-N-methyl-N-(2-thiophen-2-ylethyl)cyclopentane-1-carboxamide;hydrochloride
PubChem CID119807064
Molecular FormulaC13H21ClN2OS
Molecular Weight288.84 g/mol
Exact Mass288.11
IUPAC Name3-amino-N-methyl-N-(2-thiophen-2-ylethyl)cyclopentane-1-carboxamide;hydrochloride
SMILESCN(CCc1cccs1)C(=O)C1CCC(N)C1.Cl
InChIInChI=1S/C13H20N2OS.ClH/c1-15(7-6-12-3-2-8-17-12)13(16)10-4-5-11(14)9-10;/h2-3,8,10-11H,4-7,9,14H2,1H3;1H
InChIKeyHVCVRFOVSBVHIR-UHFFFAOYSA-N
XLogP2.30
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.84
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-(2-thiophen-2-ylethyl)cyclopentanecarboxamide
CID 110733430
(2S,4S)-N,2-dimethyl-N-(2-thiophen-2-ylethyl)piperidine-4-carboxamide;hydrochloride
CID 120636609
4-amino-N-methyl-N-(thiophen-2-ylmethyl)cyclohexane-1-carboxamide
CID 54928756
3-amino-N-methyl-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)cyclopentane-1-carboxamide;dihydrochloride
CID 119880755
3-amino-N-methyl-N-(4-phenylbutyl)cyclopentane-1-carboxamide
CID 66009595
thiophen-2-ylmethyl 3-aminocyclopentane-1-carboxylate
CID 66031603
2-(cyclopropylmethylamino)-N-methyl-N-(2-thiophen-2-ylethyl)acetamide;hydrochloride
CID 119807077
3-amino-N-propan-2-yl-N-(thiophen-2-ylmethyl)cyclohexane-1-carboxamide
CID 63044895
(2S,4S)-4-hydroxy-N-methyl-N-(2-thiophen-2-ylethyl)pyrrolidine-2-carboxamide
CID 124516580
4-[methyl(2-thiophen-2-ylethyl)amino]cyclohexane-1-carboxylic acid
CID 115149148
N-methyl-N-(thiophen-2-ylmethyl)piperidine-4-carboxamide;hydrochloride
CID 119267119
3-amino-N-methyl-N-[(4-methylsulfinylphenyl)methyl]cyclopentane-1-carboxamide;hydrochloride
CID 119807766

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-methyl-N-(2-thiophen-2-ylethyl)cyclopentane-1-carboxamide;hydrochloride?
The IUPAC name of 3-amino-N-methyl-N-(2-thiophen-2-ylethyl)cyclopentane-1-carboxamide;hydrochloride (CID 119807064) is 3-amino-N-methyl-N-(2-thiophen-2-ylethyl)cyclopentane-1-carboxamide;hydrochloride.
What is the SMILES notation for 3-amino-N-methyl-N-(2-thiophen-2-ylethyl)cyclopentane-1-carboxamide;hydrochloride?
The canonical SMILES for 3-amino-N-methyl-N-(2-thiophen-2-ylethyl)cyclopentane-1-carboxamide;hydrochloride is CN(CCc1cccs1)C(=O)C1CCC(N)C1.Cl.
What is the InChIKey of 3-amino-N-methyl-N-(2-thiophen-2-ylethyl)cyclopentane-1-carboxamide;hydrochloride?
The InChIKey is HVCVRFOVSBVHIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2OS.ClH/c1-15(7-6-12-3-2-8-17-12)13(16)10-4-5-11(14)9-10;/h2-3,8,10-11H,4-7,9,14H2,1H3;1H.
What are the key properties of 3-amino-N-methyl-N-(2-thiophen-2-ylethyl)cyclopentane-1-carboxamide;hydrochloride?
3-amino-N-methyl-N-(2-thiophen-2-ylethyl)cyclopentane-1-carboxamide;hydrochloride has a molecular weight of 288.84 g/mol, XLogP of 2.30, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-methyl-N-(2-thiophen-2-ylethyl)cyclopentane-1-carboxamide;hydrochloride is sourced from PubChem (CID 119807064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).