N-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)-1-thiophen-3-ylmethanamine

C15H24N2S — CID 79058952

IUPACN-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)-1-thiophen-3-ylmethanamine
SMILESCNC(c1ccsc1)C1(N2CCCC2)CCCC1
InChIInChI=1S/C15H24N2S/c1-16-14(13-6-11-18-12-13)15(7-2-3-8-15)17-9-4-5-10-17/h6,11-12,14,16H,2-5,7-10H2,1H3
InChIKeyPOKOMGYKDBCMPR-UHFFFAOYSA-N
MW264.44 g/mol
LogP3.42
Rot. Bonds4

About N-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)-1-thiophen-3-ylmethanamine

N-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)-1-thiophen-3-ylmethanamine (PubChem CID 79058952) has the molecular formula C15H24N2S and a molecular weight of 264.44 g/mol. Its IUPAC name is N-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)-1-thiophen-3-ylmethanamine.

Molecular Properties

Compound NameN-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)-1-thiophen-3-ylmethanamine
PubChem CID79058952
Molecular FormulaC15H24N2S
Molecular Weight264.44 g/mol
Exact Mass264.17
IUPAC NameN-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)-1-thiophen-3-ylmethanamine
SMILESCNC(c1ccsc1)C1(N2CCCC2)CCCC1
InChIInChI=1S/C15H24N2S/c1-16-14(13-6-11-18-12-13)15(7-2-3-8-15)17-9-4-5-10-17/h6,11-12,14,16H,2-5,7-10H2,1H3
InChIKeyPOKOMGYKDBCMPR-UHFFFAOYSA-N
XLogP3.42
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.44
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)-1-thiophen-3-ylmethanamine?
The IUPAC name of N-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)-1-thiophen-3-ylmethanamine (CID 79058952) is N-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)-1-thiophen-3-ylmethanamine.
What is the SMILES notation for N-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)-1-thiophen-3-ylmethanamine?
The canonical SMILES for N-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)-1-thiophen-3-ylmethanamine is CNC(c1ccsc1)C1(N2CCCC2)CCCC1.
What is the InChIKey of N-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)-1-thiophen-3-ylmethanamine?
The InChIKey is POKOMGYKDBCMPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2S/c1-16-14(13-6-11-18-12-13)15(7-2-3-8-15)17-9-4-5-10-17/h6,11-12,14,16H,2-5,7-10H2,1H3.
What are the key properties of N-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)-1-thiophen-3-ylmethanamine?
N-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)-1-thiophen-3-ylmethanamine has a molecular weight of 264.44 g/mol, XLogP of 3.42, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)-1-thiophen-3-ylmethanamine is sourced from PubChem (CID 79058952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).