1,5-dimethyl-N-(2-thiophen-2-ylethyl)pyrrolidin-3-amine

C12H20N2S — CID 81300569

IUPAC1,5-dimethyl-N-(2-thiophen-2-ylethyl)pyrrolidin-3-amine
SMILESCC1CC(NCCc2cccs2)CN1C
InChIInChI=1S/C12H20N2S/c1-10-8-11(9-14(10)2)13-6-5-12-4-3-7-15-12/h3-4,7,10-11,13H,5-6,8-9H2,1-2H3
InChIKeySWSNYJBYOVPORV-UHFFFAOYSA-N
MW224.37 g/mol
LogP1.97
Rot. Bonds4

About 1,5-dimethyl-N-(2-thiophen-2-ylethyl)pyrrolidin-3-amine

1,5-dimethyl-N-(2-thiophen-2-ylethyl)pyrrolidin-3-amine (PubChem CID 81300569) has the molecular formula C12H20N2S and a molecular weight of 224.37 g/mol. Its IUPAC name is 1,5-dimethyl-N-(2-thiophen-2-ylethyl)pyrrolidin-3-amine.

Molecular Properties

Compound Name1,5-dimethyl-N-(2-thiophen-2-ylethyl)pyrrolidin-3-amine
PubChem CID81300569
Molecular FormulaC12H20N2S
Molecular Weight224.37 g/mol
Exact Mass224.13
IUPAC Name1,5-dimethyl-N-(2-thiophen-2-ylethyl)pyrrolidin-3-amine
SMILESCC1CC(NCCc2cccs2)CN1C
InChIInChI=1S/C12H20N2S/c1-10-8-11(9-14(10)2)13-6-5-12-4-3-7-15-12/h3-4,7,10-11,13H,5-6,8-9H2,1-2H3
InChIKeySWSNYJBYOVPORV-UHFFFAOYSA-N
XLogP1.97
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.37
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1,5-dimethyl-N-[2-(2-methylphenyl)ethyl]pyrrolidin-3-amine
CID 81301413
N-[2-(3,4-dimethylpiperazin-1-yl)ethyl]-2-thiophen-2-ylethanamine
CID 55216427
4-chloro-N-(2-thiophen-2-ylethyl)cyclohexan-1-amine
CID 65023554
3-(2-bromophenyl)-N-(2-thiophen-2-ylethyl)cyclobutan-1-amine
CID 43633671
N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-1,5-dimethylpyrrolidin-3-amine
CID 81301541
(2S,3R)-2-methyl-N-(2-thiophen-2-ylethyl)oxolan-3-amine
CID 97358153
1,2-dimethyl-N-(1-thiophen-2-ylpropan-2-yl)piperidin-4-amine
CID 81302365
3-(2-methylpropyl)-N-(2-thiophen-2-ylethyl)cyclohexan-1-amine
CID 107427921
4-bromo-2-methyl-1-(2-thiophen-2-ylethyl)pyrrolidine
CID 130948914
2-[(1,5-dimethylpyrrolidin-3-yl)amino]ethanesulfonamide
CID 81466039
N-[(2-ethylphenyl)methyl]-1,5-dimethylpyrrolidin-3-amine
CID 81338197
2-(3,5-dimethylpiperidin-1-yl)-N-(2-thiophen-2-ylethyl)propanamide
CID 75858751

Frequently Asked Questions

What is the IUPAC name of 1,5-dimethyl-N-(2-thiophen-2-ylethyl)pyrrolidin-3-amine?
The IUPAC name of 1,5-dimethyl-N-(2-thiophen-2-ylethyl)pyrrolidin-3-amine (CID 81300569) is 1,5-dimethyl-N-(2-thiophen-2-ylethyl)pyrrolidin-3-amine.
What is the SMILES notation for 1,5-dimethyl-N-(2-thiophen-2-ylethyl)pyrrolidin-3-amine?
The canonical SMILES for 1,5-dimethyl-N-(2-thiophen-2-ylethyl)pyrrolidin-3-amine is CC1CC(NCCc2cccs2)CN1C.
What is the InChIKey of 1,5-dimethyl-N-(2-thiophen-2-ylethyl)pyrrolidin-3-amine?
The InChIKey is SWSNYJBYOVPORV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2S/c1-10-8-11(9-14(10)2)13-6-5-12-4-3-7-15-12/h3-4,7,10-11,13H,5-6,8-9H2,1-2H3.
What are the key properties of 1,5-dimethyl-N-(2-thiophen-2-ylethyl)pyrrolidin-3-amine?
1,5-dimethyl-N-(2-thiophen-2-ylethyl)pyrrolidin-3-amine has a molecular weight of 224.37 g/mol, XLogP of 1.97, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethyl-N-(2-thiophen-2-ylethyl)pyrrolidin-3-amine is sourced from PubChem (CID 81300569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).