(1R)-N-[[5-(furan-3-yl)-1,2,4-oxadiazol-3-yl]methyl]-N-methyl-1-thiophen-2-ylethanamine

C14H15N3O2S — CID 95277704

IUPAC(1R)-N-[[5-(furan-3-yl)-1,2,4-oxadiazol-3-yl]methyl]-N-methyl-1-thiophen-2-ylethanamine
SMILESC[C@H](c1cccs1)N(C)Cc1noc(-c2ccoc2)n1
InChIInChI=1S/C14H15N3O2S/c1-10(12-4-3-7-20-12)17(2)8-13-15-14(19-16-13)11-5-6-18-9-11/h3-7,9-10H,8H2,1-2H3/t10-/m1/s1
InChIKeyFWPFQPSGPDOSOW-SNVBAGLBSA-N
MW289.36 g/mol
LogP3.58
Rot. Bonds5

About (1R)-N-[[5-(furan-3-yl)-1,2,4-oxadiazol-3-yl]methyl]-N-methyl-1-thiophen-2-ylethanamine

(1R)-N-[[5-(furan-3-yl)-1,2,4-oxadiazol-3-yl]methyl]-N-methyl-1-thiophen-2-ylethanamine (PubChem CID 95277704) has the molecular formula C14H15N3O2S and a molecular weight of 289.36 g/mol. Its IUPAC name is (1R)-N-[[5-(furan-3-yl)-1,2,4-oxadiazol-3-yl]methyl]-N-methyl-1-thiophen-2-ylethanamine.

Molecular Properties

Compound Name(1R)-N-[[5-(furan-3-yl)-1,2,4-oxadiazol-3-yl]methyl]-N-methyl-1-thiophen-2-ylethanamine
PubChem CID95277704
Molecular FormulaC14H15N3O2S
Molecular Weight289.36 g/mol
Exact Mass289.09
IUPAC Name(1R)-N-[[5-(furan-3-yl)-1,2,4-oxadiazol-3-yl]methyl]-N-methyl-1-thiophen-2-ylethanamine
SMILESC[C@H](c1cccs1)N(C)Cc1noc(-c2ccoc2)n1
InChIInChI=1S/C14H15N3O2S/c1-10(12-4-3-7-20-12)17(2)8-13-15-14(19-16-13)11-5-6-18-9-11/h3-7,9-10H,8H2,1-2H3/t10-/m1/s1
InChIKeyFWPFQPSGPDOSOW-SNVBAGLBSA-N
XLogP3.58
TPSA55.30 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.36
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze (1R)-N-[[5-(furan-3-yl)-1,2,4-oxadiazol-3-yl]methyl]-N-methyl-1-thiophen-2-ylethanamine with MolForge

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Related Compounds

5-(furan-3-yl)-3-propyl-1,2,4-oxadiazole
CID 130708265
5-phenyl-3-(1-thiophen-2-ylethylsulfinylmethyl)-1,2,4-oxadiazole
CID 84591571
N-(furan-3-ylmethyl)-N'-methyl-N'-(1-thiophen-2-ylethyl)ethane-1,2-diamine
CID 55089294
2-[5-(furan-3-yl)-1,2,4-oxadiazol-3-yl]acetonitrile
CID 95911598
N-[[2-(furan-3-yl)-1,3-thiazol-4-yl]methyl]-N-methyl-1-pyridin-4-ylethanamine
CID 126768185
2-[5-[[methyl(1-thiophen-2-ylethyl)amino]methyl]-1,2,4-oxadiazol-3-yl]propan-2-amine;hydrochloride
CID 119930333
N-methyl-N-[[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl]thiophene-2-sulfonamide
CID 47059713
(1S)-N-methyl-N-[(5-methyl-2-thiophen-3-yl-1,3-oxazol-4-yl)methyl]-1-thiophen-2-ylethanamine
CID 25491748
N-methyl-1-thiophen-2-yl-N-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]ethanamine
CID 78827467
(1R)-N-(1,3-benzoxazol-2-ylmethyl)-N-methyl-1-thiophen-2-ylethanamine
CID 94489500
N-[(4-methoxyphenyl)methyl]-N-methyl-1-thiophen-2-ylethanamine
CID 134794915
(1S)-N-methyl-N-[[5-methyl-2-(2-methylphenyl)-1,3-oxazol-4-yl]methyl]-1-thiophen-2-ylethanamine
CID 42379215

Frequently Asked Questions

What is the IUPAC name of (1R)-N-[[5-(furan-3-yl)-1,2,4-oxadiazol-3-yl]methyl]-N-methyl-1-thiophen-2-ylethanamine?
The IUPAC name of (1R)-N-[[5-(furan-3-yl)-1,2,4-oxadiazol-3-yl]methyl]-N-methyl-1-thiophen-2-ylethanamine (CID 95277704) is (1R)-N-[[5-(furan-3-yl)-1,2,4-oxadiazol-3-yl]methyl]-N-methyl-1-thiophen-2-ylethanamine.
What is the SMILES notation for (1R)-N-[[5-(furan-3-yl)-1,2,4-oxadiazol-3-yl]methyl]-N-methyl-1-thiophen-2-ylethanamine?
The canonical SMILES for (1R)-N-[[5-(furan-3-yl)-1,2,4-oxadiazol-3-yl]methyl]-N-methyl-1-thiophen-2-ylethanamine is C[C@H](c1cccs1)N(C)Cc1noc(-c2ccoc2)n1.
What is the InChIKey of (1R)-N-[[5-(furan-3-yl)-1,2,4-oxadiazol-3-yl]methyl]-N-methyl-1-thiophen-2-ylethanamine?
The InChIKey is FWPFQPSGPDOSOW-SNVBAGLBSA-N. The full InChI is InChI=1S/C14H15N3O2S/c1-10(12-4-3-7-20-12)17(2)8-13-15-14(19-16-13)11-5-6-18-9-11/h3-7,9-10H,8H2,1-2H3/t10-/m1/s1.
What are the key properties of (1R)-N-[[5-(furan-3-yl)-1,2,4-oxadiazol-3-yl]methyl]-N-methyl-1-thiophen-2-ylethanamine?
(1R)-N-[[5-(furan-3-yl)-1,2,4-oxadiazol-3-yl]methyl]-N-methyl-1-thiophen-2-ylethanamine has a molecular weight of 289.36 g/mol, XLogP of 3.58, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-N-[[5-(furan-3-yl)-1,2,4-oxadiazol-3-yl]methyl]-N-methyl-1-thiophen-2-ylethanamine is sourced from PubChem (CID 95277704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).