(2R)-N-ethyl-2-[propyl-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]amino]propanamide

C15H22N4O2S — CID 8689926

IUPAC(2R)-N-ethyl-2-[propyl-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]amino]propanamide
SMILESCCCN(Cc1nnc(-c2cccs2)o1)[C@H](C)C(=O)NCC
InChIInChI=1S/C15H22N4O2S/c1-4-8-19(11(3)14(20)16-5-2)10-13-17-18-15(21-13)12-7-6-9-22-12/h6-7,9,11H,4-5,8,10H2,1-3H3,(H,16,20)/t11-/m1/s1
InChIKeyRPQTYXASMQOUCG-LLVKDONJSA-N
MW322.43 g/mol
LogP2.53
Rot. Bonds8

About (2R)-N-ethyl-2-[propyl-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]amino]propanamide

(2R)-N-ethyl-2-[propyl-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]amino]propanamide (PubChem CID 8689926) has the molecular formula C15H22N4O2S and a molecular weight of 322.43 g/mol. Its IUPAC name is (2R)-N-ethyl-2-[propyl-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]amino]propanamide.

Molecular Properties

Compound Name(2R)-N-ethyl-2-[propyl-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]amino]propanamide
PubChem CID8689926
Molecular FormulaC15H22N4O2S
Molecular Weight322.43 g/mol
Exact Mass322.15
IUPAC Name(2R)-N-ethyl-2-[propyl-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]amino]propanamide
SMILESCCCN(Cc1nnc(-c2cccs2)o1)[C@H](C)C(=O)NCC
InChIInChI=1S/C15H22N4O2S/c1-4-8-19(11(3)14(20)16-5-2)10-13-17-18-15(21-13)12-7-6-9-22-12/h6-7,9,11H,4-5,8,10H2,1-3H3,(H,16,20)/t11-/m1/s1
InChIKeyRPQTYXASMQOUCG-LLVKDONJSA-N
XLogP2.53
TPSA71.26 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.43
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze (2R)-N-ethyl-2-[propyl-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]amino]propanamide with MolForge

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Related Compounds

(2R)-2-[2-methoxyethyl-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]amino]-N-(methylcarbamoyl)propanamide
CID 9375100
N-(4-propan-2-ylphenyl)-2-[propyl-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]amino]acetamide
CID 9372310
ethyl 2-[propyl-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]amino]acetate
CID 60673442
N-[1-(4-ethylphenyl)ethyl]-2-[propyl-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]amino]acetamide
CID 18088478
2-[propyl-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]amino]-N-(2-thiophen-2-ylethylcarbamoyl)acetamide
CID 18197617
methyl 2-methyl-3-[methyl-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]amino]propanoate
CID 62011302
3-ethyl-1-(2-methoxyethyl)-1-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]thiourea
CID 8678585
2-(4-acetylpiperazin-1-yl)-N-propyl-N-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]acetamide
CID 55410072
N-methyl-1-thiophen-2-yl-N-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]ethanamine
CID 78827467
N-(3-tert-butyl-1,2-oxazol-5-yl)-2-[propyl-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]amino]acetamide
CID 8689948
[2-(tert-butylamino)-2-oxoethyl]-methyl-[2-oxo-2-[propyl-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]amino]ethyl]azanium
CID 8768546
methyl 3-[[2-[propyl-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]amino]acetyl]amino]thiophene-2-carboxylate
CID 24566610

Frequently Asked Questions

What is the IUPAC name of (2R)-N-ethyl-2-[propyl-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]amino]propanamide?
The IUPAC name of (2R)-N-ethyl-2-[propyl-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]amino]propanamide (CID 8689926) is (2R)-N-ethyl-2-[propyl-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]amino]propanamide.
What is the SMILES notation for (2R)-N-ethyl-2-[propyl-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]amino]propanamide?
The canonical SMILES for (2R)-N-ethyl-2-[propyl-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]amino]propanamide is CCCN(Cc1nnc(-c2cccs2)o1)[C@H](C)C(=O)NCC.
What is the InChIKey of (2R)-N-ethyl-2-[propyl-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]amino]propanamide?
The InChIKey is RPQTYXASMQOUCG-LLVKDONJSA-N. The full InChI is InChI=1S/C15H22N4O2S/c1-4-8-19(11(3)14(20)16-5-2)10-13-17-18-15(21-13)12-7-6-9-22-12/h6-7,9,11H,4-5,8,10H2,1-3H3,(H,16,20)/t11-/m1/s1.
What are the key properties of (2R)-N-ethyl-2-[propyl-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]amino]propanamide?
(2R)-N-ethyl-2-[propyl-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]amino]propanamide has a molecular weight of 322.43 g/mol, XLogP of 2.53, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-ethyl-2-[propyl-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]amino]propanamide is sourced from PubChem (CID 8689926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).