N-methyl-1-(3-methylcyclopentyl)-2-thiophen-3-ylethanamine

C13H21NS — CID 65413967

IUPACN-methyl-1-(3-methylcyclopentyl)-2-thiophen-3-ylethanamine
SMILESCNC(Cc1ccsc1)C1CCC(C)C1
InChIInChI=1S/C13H21NS/c1-10-3-4-12(7-10)13(14-2)8-11-5-6-15-9-11/h5-6,9-10,12-14H,3-4,7-8H2,1-2H3
InChIKeyHFTHYTYHJJGPHS-UHFFFAOYSA-N
MW223.38 g/mol
LogP3.31
Rot. Bonds4

About N-methyl-1-(3-methylcyclopentyl)-2-thiophen-3-ylethanamine

N-methyl-1-(3-methylcyclopentyl)-2-thiophen-3-ylethanamine (PubChem CID 65413967) has the molecular formula C13H21NS and a molecular weight of 223.38 g/mol. Its IUPAC name is N-methyl-1-(3-methylcyclopentyl)-2-thiophen-3-ylethanamine.

Molecular Properties

Compound NameN-methyl-1-(3-methylcyclopentyl)-2-thiophen-3-ylethanamine
PubChem CID65413967
Molecular FormulaC13H21NS
Molecular Weight223.38 g/mol
Exact Mass223.14
IUPAC NameN-methyl-1-(3-methylcyclopentyl)-2-thiophen-3-ylethanamine
SMILESCNC(Cc1ccsc1)C1CCC(C)C1
InChIInChI=1S/C13H21NS/c1-10-3-4-12(7-10)13(14-2)8-11-5-6-15-9-11/h5-6,9-10,12-14H,3-4,7-8H2,1-2H3
InChIKeyHFTHYTYHJJGPHS-UHFFFAOYSA-N
XLogP3.31
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.38
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-1-(4-propan-2-ylcyclohexyl)-2-thiophen-3-ylethanamine
CID 65423218
N-methyl-1-(5-methyloxolan-2-yl)-2-thiophen-3-ylethanamine
CID 115845115
1-cyclopropyl-N-methyl-3-thiophen-3-ylpropan-1-amine
CID 63354899
1-(3-ethylcyclopentyl)-N-methyl-3-thiophen-3-ylpropan-1-amine
CID 65411999
1-cyclopropyl-N-(1-thiophen-3-ylpropan-2-yl)butan-1-amine
CID 115769840
2-(4-bromophenyl)-N-methyl-1-(3-methylcyclohexyl)ethanamine
CID 55186434
2-(2-methoxyphenyl)-N-methyl-1-(3-methylcyclopentyl)ethanamine
CID 65414979
N-methyl-1-(thian-4-yl)-3-thiophen-3-ylpropan-2-amine
CID 105137524
3-cyclopropyl-1-thiophen-3-ylbutan-2-amine
CID 83155210
2-cyclopentyl-N-methyl-3-thiophen-3-ylpropan-1-amine
CID 112569789
2-(2,5-dichlorophenyl)-N-methyl-1-(3-methylcyclopentyl)ethanamine
CID 65414577
N-[1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-2-thiophen-3-ylethyl]propan-1-amine
CID 115998337

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(3-methylcyclopentyl)-2-thiophen-3-ylethanamine?
The IUPAC name of N-methyl-1-(3-methylcyclopentyl)-2-thiophen-3-ylethanamine (CID 65413967) is N-methyl-1-(3-methylcyclopentyl)-2-thiophen-3-ylethanamine.
What is the SMILES notation for N-methyl-1-(3-methylcyclopentyl)-2-thiophen-3-ylethanamine?
The canonical SMILES for N-methyl-1-(3-methylcyclopentyl)-2-thiophen-3-ylethanamine is CNC(Cc1ccsc1)C1CCC(C)C1.
What is the InChIKey of N-methyl-1-(3-methylcyclopentyl)-2-thiophen-3-ylethanamine?
The InChIKey is HFTHYTYHJJGPHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NS/c1-10-3-4-12(7-10)13(14-2)8-11-5-6-15-9-11/h5-6,9-10,12-14H,3-4,7-8H2,1-2H3.
What are the key properties of N-methyl-1-(3-methylcyclopentyl)-2-thiophen-3-ylethanamine?
N-methyl-1-(3-methylcyclopentyl)-2-thiophen-3-ylethanamine has a molecular weight of 223.38 g/mol, XLogP of 3.31, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(3-methylcyclopentyl)-2-thiophen-3-ylethanamine is sourced from PubChem (CID 65413967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).