N-(4-methyl-2-morpholin-4-ylpentyl)-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide

C19H28N4O3S — CID 134053199

IUPACN-(4-methyl-2-morpholin-4-ylpentyl)-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide
SMILESCC(C)CC(CNC(=O)CCc1nnc(-c2ccsc2)o1)N1CCOCC1
InChIInChI=1S/C19H28N4O3S/c1-14(2)11-16(23-6-8-25-9-7-23)12-20-17(24)3-4-18-21-22-19(26-18)15-5-10-27-13-15/h5,10,13-14,16H,3-4,6-9,11-12H2,1-2H3,(H,20,24)
InChIKeyGYWSIMCAXXOSIZ-UHFFFAOYSA-N
MW392.53 g/mol
LogP2.59
Rot. Bonds9

About N-(4-methyl-2-morpholin-4-ylpentyl)-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide

N-(4-methyl-2-morpholin-4-ylpentyl)-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide (PubChem CID 134053199) has the molecular formula C19H28N4O3S and a molecular weight of 392.53 g/mol. Its IUPAC name is N-(4-methyl-2-morpholin-4-ylpentyl)-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide.

Molecular Properties

Compound NameN-(4-methyl-2-morpholin-4-ylpentyl)-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide
PubChem CID134053199
Molecular FormulaC19H28N4O3S
Molecular Weight392.53 g/mol
Exact Mass392.19
IUPAC NameN-(4-methyl-2-morpholin-4-ylpentyl)-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide
SMILESCC(C)CC(CNC(=O)CCc1nnc(-c2ccsc2)o1)N1CCOCC1
InChIInChI=1S/C19H28N4O3S/c1-14(2)11-16(23-6-8-25-9-7-23)12-20-17(24)3-4-18-21-22-19(26-18)15-5-10-27-13-15/h5,10,13-14,16H,3-4,6-9,11-12H2,1-2H3,(H,20,24)
InChIKeyGYWSIMCAXXOSIZ-UHFFFAOYSA-N
XLogP2.59
TPSA80.49 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.53
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-(3-methyl-2-morpholin-4-ylbutyl)-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide
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CID 51886384
3-[5-(3,4-dimethylphenyl)-1,3-oxazol-2-yl]-N-[(2R)-4-methyl-2-morpholin-4-ylpentyl]propanamide
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N-(4-piperidin-1-ylphenyl)-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide
CID 55536464
N-[(4-methylphenyl)methyl]-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide
CID 38039853
N-[2-oxo-2-(propylamino)ethyl]-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide
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N-(4-propan-2-ylphenyl)-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide
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3-(3,4-dimethoxyphenyl)-N-(4-methyl-2-morpholin-4-ylpentyl)propanamide
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N-[(4-cyclopropylmorpholin-2-yl)methyl]-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide
CID 126776239
N-[1-(1-adamantyl)ethyl]-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide
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N-[(5-bromothiophen-2-yl)methyl]-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide
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Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-2-morpholin-4-ylpentyl)-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide?
The IUPAC name of N-(4-methyl-2-morpholin-4-ylpentyl)-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide (CID 134053199) is N-(4-methyl-2-morpholin-4-ylpentyl)-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide.
What is the SMILES notation for N-(4-methyl-2-morpholin-4-ylpentyl)-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide?
The canonical SMILES for N-(4-methyl-2-morpholin-4-ylpentyl)-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide is CC(C)CC(CNC(=O)CCc1nnc(-c2ccsc2)o1)N1CCOCC1.
What is the InChIKey of N-(4-methyl-2-morpholin-4-ylpentyl)-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide?
The InChIKey is GYWSIMCAXXOSIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N4O3S/c1-14(2)11-16(23-6-8-25-9-7-23)12-20-17(24)3-4-18-21-22-19(26-18)15-5-10-27-13-15/h5,10,13-14,16H,3-4,6-9,11-12H2,1-2H3,(H,20,24).
What are the key properties of N-(4-methyl-2-morpholin-4-ylpentyl)-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide?
N-(4-methyl-2-morpholin-4-ylpentyl)-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide has a molecular weight of 392.53 g/mol, XLogP of 2.59, 9 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-2-morpholin-4-ylpentyl)-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)propanamide is sourced from PubChem (CID 134053199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).