N-[(1-pyrrolidin-1-ylcyclopentyl)-thiophen-2-ylmethyl]ethanamine

C16H26N2S — CID 79058723

IUPACN-[(1-pyrrolidin-1-ylcyclopentyl)-thiophen-2-ylmethyl]ethanamine
SMILESCCNC(c1cccs1)C1(N2CCCC2)CCCC1
InChIInChI=1S/C16H26N2S/c1-2-17-15(14-8-7-13-19-14)16(9-3-4-10-16)18-11-5-6-12-18/h7-8,13,15,17H,2-6,9-12H2,1H3
InChIKeyMPMLUXGEMLNJIT-UHFFFAOYSA-N
MW278.46 g/mol
LogP3.81
Rot. Bonds5

About N-[(1-pyrrolidin-1-ylcyclopentyl)-thiophen-2-ylmethyl]ethanamine

N-[(1-pyrrolidin-1-ylcyclopentyl)-thiophen-2-ylmethyl]ethanamine (PubChem CID 79058723) has the molecular formula C16H26N2S and a molecular weight of 278.46 g/mol. Its IUPAC name is N-[(1-pyrrolidin-1-ylcyclopentyl)-thiophen-2-ylmethyl]ethanamine.

Molecular Properties

Compound NameN-[(1-pyrrolidin-1-ylcyclopentyl)-thiophen-2-ylmethyl]ethanamine
PubChem CID79058723
Molecular FormulaC16H26N2S
Molecular Weight278.46 g/mol
Exact Mass278.18
IUPAC NameN-[(1-pyrrolidin-1-ylcyclopentyl)-thiophen-2-ylmethyl]ethanamine
SMILESCCNC(c1cccs1)C1(N2CCCC2)CCCC1
InChIInChI=1S/C16H26N2S/c1-2-17-15(14-8-7-13-19-14)16(9-3-4-10-16)18-11-5-6-12-18/h7-8,13,15,17H,2-6,9-12H2,1H3
InChIKeyMPMLUXGEMLNJIT-UHFFFAOYSA-N
XLogP3.81
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.46
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[(1-pyrrolidin-1-ylcyclopentyl)-thiophen-2-ylmethyl]ethanamine with MolForge

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Related Compounds

N-methyl-1-(1-morpholin-4-ylcyclopentyl)-1-thiophen-2-ylmethanamine
CID 79066848
N-ethyl-1-(1-morpholin-4-ylcyclopentyl)-2-thiophen-2-ylethanamine
CID 79060861
N-[(1-piperidin-1-ylcyclohexyl)methyl]-1-thiophen-2-ylethanamine
CID 43100305
N-ethyl-1-(1-piperidin-1-ylcyclopentyl)-2-(1,3-thiazol-2-yl)ethanamine
CID 79826954
N-[(1-piperidin-1-ylcyclopentyl)-pyrazin-2-ylmethyl]ethanamine
CID 79058513
2-(azepan-1-yl)-N-ethyl-2-methyl-1-thiophen-2-ylpropan-1-amine
CID 79051539
N-methyl-1-(3-methylthiophen-2-yl)-1-(1-pyrrolidin-1-ylcyclopentyl)methanamine
CID 79988934
1-(1-pyrrolidin-1-ylcyclopentyl)-3-thiophen-2-ylpropan-1-amine
CID 79057434
[(2-methylthiophen-3-yl)-(1-piperidin-1-ylcyclopentyl)methyl]hydrazine
CID 102842888
1-(1-piperidin-1-ylcyclopentyl)-3-thiophen-2-ylpropan-1-amine
CID 79059762
(1-morpholin-4-ylcyclopentyl)-thiophen-2-ylmethanol
CID 79060219
N-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)-1-thiophen-3-ylmethanamine
CID 79058952

Frequently Asked Questions

What is the IUPAC name of N-[(1-pyrrolidin-1-ylcyclopentyl)-thiophen-2-ylmethyl]ethanamine?
The IUPAC name of N-[(1-pyrrolidin-1-ylcyclopentyl)-thiophen-2-ylmethyl]ethanamine (CID 79058723) is N-[(1-pyrrolidin-1-ylcyclopentyl)-thiophen-2-ylmethyl]ethanamine.
What is the SMILES notation for N-[(1-pyrrolidin-1-ylcyclopentyl)-thiophen-2-ylmethyl]ethanamine?
The canonical SMILES for N-[(1-pyrrolidin-1-ylcyclopentyl)-thiophen-2-ylmethyl]ethanamine is CCNC(c1cccs1)C1(N2CCCC2)CCCC1.
What is the InChIKey of N-[(1-pyrrolidin-1-ylcyclopentyl)-thiophen-2-ylmethyl]ethanamine?
The InChIKey is MPMLUXGEMLNJIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2S/c1-2-17-15(14-8-7-13-19-14)16(9-3-4-10-16)18-11-5-6-12-18/h7-8,13,15,17H,2-6,9-12H2,1H3.
What are the key properties of N-[(1-pyrrolidin-1-ylcyclopentyl)-thiophen-2-ylmethyl]ethanamine?
N-[(1-pyrrolidin-1-ylcyclopentyl)-thiophen-2-ylmethyl]ethanamine has a molecular weight of 278.46 g/mol, XLogP of 3.81, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-pyrrolidin-1-ylcyclopentyl)-thiophen-2-ylmethyl]ethanamine is sourced from PubChem (CID 79058723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).