2-[[[(1R)-1-(furan-2-yl)ethyl]amino]methyl]thiophen-3-amine

C11H14N2OS — CID 81403332

IUPAC2-[[[(1R)-1-(furan-2-yl)ethyl]amino]methyl]thiophen-3-amine
SMILESC[C@@H](NCc1sccc1N)c1ccco1
InChIInChI=1S/C11H14N2OS/c1-8(10-3-2-5-14-10)13-7-11-9(12)4-6-15-11/h2-6,8,13H,7,12H2,1H3/t8-/m1/s1
InChIKeyXTWPHEAHIATYTP-MRVPVSSYSA-N
MW222.31 g/mol
LogP2.77
Rot. Bonds4

About 2-[[[(1R)-1-(furan-2-yl)ethyl]amino]methyl]thiophen-3-amine

2-[[[(1R)-1-(furan-2-yl)ethyl]amino]methyl]thiophen-3-amine (PubChem CID 81403332) has the molecular formula C11H14N2OS and a molecular weight of 222.31 g/mol. Its IUPAC name is 2-[[[(1R)-1-(furan-2-yl)ethyl]amino]methyl]thiophen-3-amine.

Molecular Properties

Compound Name2-[[[(1R)-1-(furan-2-yl)ethyl]amino]methyl]thiophen-3-amine
PubChem CID81403332
Molecular FormulaC11H14N2OS
Molecular Weight222.31 g/mol
Exact Mass222.08
IUPAC Name2-[[[(1R)-1-(furan-2-yl)ethyl]amino]methyl]thiophen-3-amine
SMILESC[C@@H](NCc1sccc1N)c1ccco1
InChIInChI=1S/C11H14N2OS/c1-8(10-3-2-5-14-10)13-7-11-9(12)4-6-15-11/h2-6,8,13H,7,12H2,1H3/t8-/m1/s1
InChIKeyXTWPHEAHIATYTP-MRVPVSSYSA-N
XLogP2.77
TPSA51.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.31
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[[[(1R)-1-(furan-2-yl)ethyl]amino]methyl]thiophen-3-amine with MolForge

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Related Compounds

(1S)-1-(furan-2-yl)-N-(1,3-thiazol-2-ylmethyl)ethanamine
CID 81403465
2-[(3-methylbutan-2-ylamino)methyl]thiophen-3-amine
CID 66386521
(1R)-1-(furan-2-yl)-N-[(4-methyl-1,3-thiazol-5-yl)methyl]ethanamine
CID 81403760
1-(furan-2-yl)-N-[(4-methyl-1,3-thiazol-5-yl)methyl]ethanamine
CID 63280404
1-(furan-2-yl)-N-[2-(3-methylthiophen-2-yl)ethyl]ethanamine
CID 115898792
2-[[[(1S)-1-(4-bromophenyl)ethyl]amino]methyl]thiophen-3-amine
CID 81360179
1-(furan-2-yl)-N-(1,3-thiazol-5-ylmethyl)ethanamine
CID 62758862
2-[[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]methyl]thiophen-3-amine
CID 66386414
(1S)-N-[(5-ethylfuran-2-yl)methyl]-1-(furan-2-yl)ethanamine
CID 81403007
N-[(5-ethylfuran-2-yl)methyl]-1-(furan-2-yl)ethanamine
CID 62346680
(1R)-1-(furan-2-yl)-N-[(5-methylfuran-2-yl)methyl]ethanamine
CID 81402622
4-[1-[(3-aminothiophen-2-yl)methylamino]ethyl]benzenesulfonamide
CID 66386535

Frequently Asked Questions

What is the IUPAC name of 2-[[[(1R)-1-(furan-2-yl)ethyl]amino]methyl]thiophen-3-amine?
The IUPAC name of 2-[[[(1R)-1-(furan-2-yl)ethyl]amino]methyl]thiophen-3-amine (CID 81403332) is 2-[[[(1R)-1-(furan-2-yl)ethyl]amino]methyl]thiophen-3-amine.
What is the SMILES notation for 2-[[[(1R)-1-(furan-2-yl)ethyl]amino]methyl]thiophen-3-amine?
The canonical SMILES for 2-[[[(1R)-1-(furan-2-yl)ethyl]amino]methyl]thiophen-3-amine is C[C@@H](NCc1sccc1N)c1ccco1.
What is the InChIKey of 2-[[[(1R)-1-(furan-2-yl)ethyl]amino]methyl]thiophen-3-amine?
The InChIKey is XTWPHEAHIATYTP-MRVPVSSYSA-N. The full InChI is InChI=1S/C11H14N2OS/c1-8(10-3-2-5-14-10)13-7-11-9(12)4-6-15-11/h2-6,8,13H,7,12H2,1H3/t8-/m1/s1.
What are the key properties of 2-[[[(1R)-1-(furan-2-yl)ethyl]amino]methyl]thiophen-3-amine?
2-[[[(1R)-1-(furan-2-yl)ethyl]amino]methyl]thiophen-3-amine has a molecular weight of 222.31 g/mol, XLogP of 2.77, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[[(1R)-1-(furan-2-yl)ethyl]amino]methyl]thiophen-3-amine is sourced from PubChem (CID 81403332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).