N-ethyl-2-[ethyl-[(1R)-1-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]ethyl]amino]acetamide

C17H24N4O2 — CID 8683321

IUPACN-ethyl-2-[ethyl-[(1R)-1-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]ethyl]amino]acetamide
SMILESCCNC(=O)CN(CC)[C@H](C)c1nnc(-c2cccc(C)c2)o1
InChIInChI=1S/C17H24N4O2/c1-5-18-15(22)11-21(6-2)13(4)16-19-20-17(23-16)14-9-7-8-12(3)10-14/h7-10,13H,5-6,11H2,1-4H3,(H,18,22)/t13-/m1/s1
InChIKeyXFPLEHUQPIIRRZ-CYBMUJFWSA-N
MW316.41 g/mol
LogP2.56
Rot. Bonds7

About N-ethyl-2-[ethyl-[(1R)-1-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]ethyl]amino]acetamide

N-ethyl-2-[ethyl-[(1R)-1-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]ethyl]amino]acetamide (PubChem CID 8683321) has the molecular formula C17H24N4O2 and a molecular weight of 316.41 g/mol. Its IUPAC name is N-ethyl-2-[ethyl-[(1R)-1-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]ethyl]amino]acetamide.

Molecular Properties

Compound NameN-ethyl-2-[ethyl-[(1R)-1-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]ethyl]amino]acetamide
PubChem CID8683321
Molecular FormulaC17H24N4O2
Molecular Weight316.41 g/mol
Exact Mass316.19
IUPAC NameN-ethyl-2-[ethyl-[(1R)-1-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]ethyl]amino]acetamide
SMILESCCNC(=O)CN(CC)[C@H](C)c1nnc(-c2cccc(C)c2)o1
InChIInChI=1S/C17H24N4O2/c1-5-18-15(22)11-21(6-2)13(4)16-19-20-17(23-16)14-9-7-8-12(3)10-14/h7-10,13H,5-6,11H2,1-4H3,(H,18,22)/t13-/m1/s1
InChIKeyXFPLEHUQPIIRRZ-CYBMUJFWSA-N
XLogP2.56
TPSA71.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.41
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[ethyl-[(1R)-1-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]ethyl]amino]acetamide?
The IUPAC name of N-ethyl-2-[ethyl-[(1R)-1-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]ethyl]amino]acetamide (CID 8683321) is N-ethyl-2-[ethyl-[(1R)-1-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]ethyl]amino]acetamide.
What is the SMILES notation for N-ethyl-2-[ethyl-[(1R)-1-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]ethyl]amino]acetamide?
The canonical SMILES for N-ethyl-2-[ethyl-[(1R)-1-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]ethyl]amino]acetamide is CCNC(=O)CN(CC)[C@H](C)c1nnc(-c2cccc(C)c2)o1.
What is the InChIKey of N-ethyl-2-[ethyl-[(1R)-1-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]ethyl]amino]acetamide?
The InChIKey is XFPLEHUQPIIRRZ-CYBMUJFWSA-N. The full InChI is InChI=1S/C17H24N4O2/c1-5-18-15(22)11-21(6-2)13(4)16-19-20-17(23-16)14-9-7-8-12(3)10-14/h7-10,13H,5-6,11H2,1-4H3,(H,18,22)/t13-/m1/s1.
What are the key properties of N-ethyl-2-[ethyl-[(1R)-1-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]ethyl]amino]acetamide?
N-ethyl-2-[ethyl-[(1R)-1-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]ethyl]amino]acetamide has a molecular weight of 316.41 g/mol, XLogP of 2.56, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[ethyl-[(1R)-1-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]ethyl]amino]acetamide is sourced from PubChem (CID 8683321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).