2-(furan-3-yl)-N-methyl-1-(thiadiazol-4-yl)ethanamine

C9H11N3OS — CID 105177550

IUPAC2-(furan-3-yl)-N-methyl-1-(thiadiazol-4-yl)ethanamine
SMILESCNC(Cc1ccoc1)c1csnn1
InChIInChI=1S/C9H11N3OS/c1-10-8(9-6-14-12-11-9)4-7-2-3-13-5-7/h2-3,5-6,8,10H,4H2,1H3
InChIKeyBNUUNTPFWCGFQC-UHFFFAOYSA-N
MW209.27 g/mol
LogP1.63
Rot. Bonds4

About 2-(furan-3-yl)-N-methyl-1-(thiadiazol-4-yl)ethanamine

2-(furan-3-yl)-N-methyl-1-(thiadiazol-4-yl)ethanamine (PubChem CID 105177550) has the molecular formula C9H11N3OS and a molecular weight of 209.27 g/mol. Its IUPAC name is 2-(furan-3-yl)-N-methyl-1-(thiadiazol-4-yl)ethanamine.

Molecular Properties

Compound Name2-(furan-3-yl)-N-methyl-1-(thiadiazol-4-yl)ethanamine
PubChem CID105177550
Molecular FormulaC9H11N3OS
Molecular Weight209.27 g/mol
Exact Mass209.06
IUPAC Name2-(furan-3-yl)-N-methyl-1-(thiadiazol-4-yl)ethanamine
SMILESCNC(Cc1ccoc1)c1csnn1
InChIInChI=1S/C9H11N3OS/c1-10-8(9-6-14-12-11-9)4-7-2-3-13-5-7/h2-3,5-6,8,10H,4H2,1H3
InChIKeyBNUUNTPFWCGFQC-UHFFFAOYSA-N
XLogP1.63
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.27
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-2-pyridin-4-yl-1-(thiadiazol-4-yl)ethanamine
CID 105160535
2-(3,4-dimethylphenyl)-N-methyl-1-(thiadiazol-4-yl)ethanamine
CID 105109451
2-(3,4-difluorophenyl)-N-methyl-1-(thiadiazol-4-yl)ethanamine
CID 105175945
2-(5-ethylthiophen-2-yl)-N-methyl-1-(thiadiazol-4-yl)ethanamine
CID 105135916
2-(3-fluorophenyl)-N-methyl-1-(thiadiazol-4-yl)ethanamine
CID 105095616
2-(furan-3-yl)-N-methyl-1-(4-methyl-2-pyridinyl)ethanamine
CID 83175534
1-(4-tert-butylthiadiazol-5-yl)-2-(furan-3-yl)-N-methylethanamine
CID 105177764
2-(furan-3-yl)-N-methyl-1-(4-propylthiadiazol-5-yl)ethanamine
CID 105177552
1-(2,5-dibromothiophen-3-yl)-2-(furan-3-yl)-N-methylethanamine
CID 107968943
2-(3-bromothiophen-2-yl)-N-methyl-1-(thiadiazol-4-yl)ethanamine
CID 105139402
1-(4-fluorophenyl)-2-(furan-3-yl)-N-methylethanamine
CID 83176188
2-(2,4-dichlorophenyl)-N-methyl-1-(thiadiazol-4-yl)ethanamine
CID 105132366

Frequently Asked Questions

What is the IUPAC name of 2-(furan-3-yl)-N-methyl-1-(thiadiazol-4-yl)ethanamine?
The IUPAC name of 2-(furan-3-yl)-N-methyl-1-(thiadiazol-4-yl)ethanamine (CID 105177550) is 2-(furan-3-yl)-N-methyl-1-(thiadiazol-4-yl)ethanamine.
What is the SMILES notation for 2-(furan-3-yl)-N-methyl-1-(thiadiazol-4-yl)ethanamine?
The canonical SMILES for 2-(furan-3-yl)-N-methyl-1-(thiadiazol-4-yl)ethanamine is CNC(Cc1ccoc1)c1csnn1.
What is the InChIKey of 2-(furan-3-yl)-N-methyl-1-(thiadiazol-4-yl)ethanamine?
The InChIKey is BNUUNTPFWCGFQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3OS/c1-10-8(9-6-14-12-11-9)4-7-2-3-13-5-7/h2-3,5-6,8,10H,4H2,1H3.
What are the key properties of 2-(furan-3-yl)-N-methyl-1-(thiadiazol-4-yl)ethanamine?
2-(furan-3-yl)-N-methyl-1-(thiadiazol-4-yl)ethanamine has a molecular weight of 209.27 g/mol, XLogP of 1.63, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-3-yl)-N-methyl-1-(thiadiazol-4-yl)ethanamine is sourced from PubChem (CID 105177550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).