1-methyl-N-(1-thiophen-2-ylpropyl)pyrrolidin-3-amine

C12H20N2S — CID 61462269

IUPAC1-methyl-N-(1-thiophen-2-ylpropyl)pyrrolidin-3-amine
SMILESCCC(NC1CCN(C)C1)c1cccs1
InChIInChI=1S/C12H20N2S/c1-3-11(12-5-4-8-15-12)13-10-6-7-14(2)9-10/h4-5,8,10-11,13H,3,6-7,9H2,1-2H3
InChIKeyRYGCZIAAXBRRDW-UHFFFAOYSA-N
MW224.37 g/mol
LogP2.49
Rot. Bonds4

About 1-methyl-N-(1-thiophen-2-ylpropyl)pyrrolidin-3-amine

1-methyl-N-(1-thiophen-2-ylpropyl)pyrrolidin-3-amine (PubChem CID 61462269) has the molecular formula C12H20N2S and a molecular weight of 224.37 g/mol. Its IUPAC name is 1-methyl-N-(1-thiophen-2-ylpropyl)pyrrolidin-3-amine.

Molecular Properties

Compound Name1-methyl-N-(1-thiophen-2-ylpropyl)pyrrolidin-3-amine
PubChem CID61462269
Molecular FormulaC12H20N2S
Molecular Weight224.37 g/mol
Exact Mass224.13
IUPAC Name1-methyl-N-(1-thiophen-2-ylpropyl)pyrrolidin-3-amine
SMILESCCC(NC1CCN(C)C1)c1cccs1
InChIInChI=1S/C12H20N2S/c1-3-11(12-5-4-8-15-12)13-10-6-7-14(2)9-10/h4-5,8,10-11,13H,3,6-7,9H2,1-2H3
InChIKeyRYGCZIAAXBRRDW-UHFFFAOYSA-N
XLogP2.49
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 ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[cyclopentyl(thiophen-2-yl)methyl]-1-methylpyrrolidin-3-amine
CID 61462402
1-prop-2-ynyl-N-(1-thiophen-2-ylpropyl)piperidin-4-amine
CID 54964413
1-cyclopropyl-5-methyl-N-(1-thiophen-2-ylpropyl)pyrrolidin-3-amine
CID 115713136
3,4-dimethyl-N-(1-thiophen-2-ylpropyl)cyclohexan-1-amine
CID 64744444
N-(1-thiophen-2-ylpropyl)spiro[4.5]decan-8-amine
CID 114817555
tert-butyl 3-(1-thiophen-2-ylpropylamino)azepane-1-carboxylate
CID 107249327
N-(1-thiophen-2-ylpropyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 55153023
tert-butyl 3-(1-thiophen-2-ylpropylamino)azetidine-1-carboxylate
CID 63303145
N-[(1-ethylpyrrolidin-3-yl)methyl]-1-thiophen-2-ylpropan-1-amine
CID 60856851
3-methyl-N-(1-thiophen-2-ylpropyl)piperidine-1-carboxamide
CID 60547129
1-methyl-N-[1-(3-nitrophenyl)propyl]pyrrolidin-3-amine
CID 61462195
N-(1,2-diphenylethyl)-1-methylpyrrolidin-3-amine
CID 61462426

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(1-thiophen-2-ylpropyl)pyrrolidin-3-amine?
The IUPAC name of 1-methyl-N-(1-thiophen-2-ylpropyl)pyrrolidin-3-amine (CID 61462269) is 1-methyl-N-(1-thiophen-2-ylpropyl)pyrrolidin-3-amine.
What is the SMILES notation for 1-methyl-N-(1-thiophen-2-ylpropyl)pyrrolidin-3-amine?
The canonical SMILES for 1-methyl-N-(1-thiophen-2-ylpropyl)pyrrolidin-3-amine is CCC(NC1CCN(C)C1)c1cccs1.
What is the InChIKey of 1-methyl-N-(1-thiophen-2-ylpropyl)pyrrolidin-3-amine?
The InChIKey is RYGCZIAAXBRRDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2S/c1-3-11(12-5-4-8-15-12)13-10-6-7-14(2)9-10/h4-5,8,10-11,13H,3,6-7,9H2,1-2H3.
What are the key properties of 1-methyl-N-(1-thiophen-2-ylpropyl)pyrrolidin-3-amine?
1-methyl-N-(1-thiophen-2-ylpropyl)pyrrolidin-3-amine has a molecular weight of 224.37 g/mol, XLogP of 2.49, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(1-thiophen-2-ylpropyl)pyrrolidin-3-amine is sourced from PubChem (CID 61462269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).