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

C15H22N4O2S — CID 95764395

IUPAC(2R)-N-[(1S)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]-2-morpholin-4-yl-2-thiophen-2-ylethanamine
SMILESCc1nnc([C@H](C)NC[C@H](c2cccs2)N2CCOCC2)o1
InChIInChI=1S/C15H22N4O2S/c1-11(15-18-17-12(2)21-15)16-10-13(14-4-3-9-22-14)19-5-7-20-8-6-19/h3-4,9,11,13,16H,5-8,10H2,1-2H3/t11-,13+/m0/s1
InChIKeyHIAKYKPIBJCTGH-WCQYABFASA-N
MW322.43 g/mol
LogP2.16
Rot. Bonds6

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

(2R)-N-[(1S)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]-2-morpholin-4-yl-2-thiophen-2-ylethanamine (PubChem CID 95764395) has the molecular formula C15H22N4O2S and a molecular weight of 322.43 g/mol. Its IUPAC name is (2R)-N-[(1S)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]-2-morpholin-4-yl-2-thiophen-2-ylethanamine.

Molecular Properties

Compound Name(2R)-N-[(1S)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]-2-morpholin-4-yl-2-thiophen-2-ylethanamine
PubChem CID95764395
Molecular FormulaC15H22N4O2S
Molecular Weight322.43 g/mol
Exact Mass322.15
IUPAC Name(2R)-N-[(1S)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]-2-morpholin-4-yl-2-thiophen-2-ylethanamine
SMILESCc1nnc([C@H](C)NC[C@H](c2cccs2)N2CCOCC2)o1
InChIInChI=1S/C15H22N4O2S/c1-11(15-18-17-12(2)21-15)16-10-13(14-4-3-9-22-14)19-5-7-20-8-6-19/h3-4,9,11,13,16H,5-8,10H2,1-2H3/t11-,13+/m0/s1
InChIKeyHIAKYKPIBJCTGH-WCQYABFASA-N
XLogP2.16
TPSA63.42 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.43
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

3,3-dimethyl-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)butan-1-amine
CID 119160582
5-tert-butyl-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-1,3,4-thiadiazol-2-amine
CID 127616527
N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)cyclopentanamine
CID 167947795
3-methyl-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)but-2-en-1-amine
CID 119160583
N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]tetrazolo[1,5-b]pyridazin-6-amine
CID 51535949
N-[(2S)-2-(4-methylpiperazin-1-yl)-2-thiophen-2-ylethyl]morpholine-4-carboxamide
CID 93159855
(2R)-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-pyrazol-1-ylpropanamide
CID 94036104
5-methyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-1,2-oxazole-3-carboxamide
CID 93482387
2-methyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]quinolin-4-amine
CID 97068034
2-methyl-1-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-3-(2-thiophen-2-ylpropyl)guanidine;hydroiodide
CID 111795328
1-tert-butyl-2-methyl-3-(2-morpholin-4-yl-2-thiophen-2-ylethyl)guanidine
CID 110966180
3-amino-2-methyl-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)butanamide;dihydrochloride
CID 120502460

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[(1S)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]-2-morpholin-4-yl-2-thiophen-2-ylethanamine?
The IUPAC name of (2R)-N-[(1S)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]-2-morpholin-4-yl-2-thiophen-2-ylethanamine (CID 95764395) is (2R)-N-[(1S)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]-2-morpholin-4-yl-2-thiophen-2-ylethanamine.
What is the SMILES notation for (2R)-N-[(1S)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]-2-morpholin-4-yl-2-thiophen-2-ylethanamine?
The canonical SMILES for (2R)-N-[(1S)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]-2-morpholin-4-yl-2-thiophen-2-ylethanamine is Cc1nnc([C@H](C)NC[C@H](c2cccs2)N2CCOCC2)o1.
What is the InChIKey of (2R)-N-[(1S)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]-2-morpholin-4-yl-2-thiophen-2-ylethanamine?
The InChIKey is HIAKYKPIBJCTGH-WCQYABFASA-N. The full InChI is InChI=1S/C15H22N4O2S/c1-11(15-18-17-12(2)21-15)16-10-13(14-4-3-9-22-14)19-5-7-20-8-6-19/h3-4,9,11,13,16H,5-8,10H2,1-2H3/t11-,13+/m0/s1.
What are the key properties of (2R)-N-[(1S)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]-2-morpholin-4-yl-2-thiophen-2-ylethanamine?
(2R)-N-[(1S)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]-2-morpholin-4-yl-2-thiophen-2-ylethanamine has a molecular weight of 322.43 g/mol, XLogP of 2.16, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[(1S)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]-2-morpholin-4-yl-2-thiophen-2-ylethanamine is sourced from PubChem (CID 95764395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).