[4-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]-morpholin-4-ylmethanone

C14H23N5O3 — CID 110395775

IUPAC[4-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]-morpholin-4-ylmethanone
SMILESCc1nnc(CCN2CCN(C(=O)N3CCOCC3)CC2)o1
InChIInChI=1S/C14H23N5O3/c1-12-15-16-13(22-12)2-3-17-4-6-18(7-5-17)14(20)19-8-10-21-11-9-19/h2-11H2,1H3
InChIKeyQYHVNERXUBMFBZ-UHFFFAOYSA-N
MW309.37 g/mol
LogP-0.01
Rot. Bonds3

About [4-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]-morpholin-4-ylmethanone

[4-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]-morpholin-4-ylmethanone (PubChem CID 110395775) has the molecular formula C14H23N5O3 and a molecular weight of 309.37 g/mol. Its IUPAC name is [4-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[4-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]-morpholin-4-ylmethanone
PubChem CID110395775
Molecular FormulaC14H23N5O3
Molecular Weight309.37 g/mol
Exact Mass309.18
IUPAC Name[4-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]-morpholin-4-ylmethanone
SMILESCc1nnc(CCN2CCN(C(=O)N3CCOCC3)CC2)o1
InChIInChI=1S/C14H23N5O3/c1-12-15-16-13(22-12)2-3-17-4-6-18(7-5-17)14(20)19-8-10-21-11-9-19/h2-11H2,1H3
InChIKeyQYHVNERXUBMFBZ-UHFFFAOYSA-N
XLogP-0.01
TPSA74.94 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 5-0.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

cyclopentyl-[4-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]methanone
CID 110395704
[4-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]-(4-morpholin-4-ylsulfonylphenyl)methanone
CID 110658417
3-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(2-morpholin-4-ylethyl)propanamide
CID 110333564
1-[4-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]-2,2-diphenylethanone
CID 110395727
(3,5-dimethoxyphenyl)-[4-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]methanone
CID 110395723
(3,4-dimethoxyphenyl)-[4-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]methanone
CID 110395729
3-(4-methoxyphenyl)-1-[4-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]propan-1-one
CID 110395779
3-(2-methoxyphenyl)-1-[4-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]propan-1-one
CID 110395785
1-[4-[3-(5-methyl-1,3,4-oxadiazol-2-yl)propanoyl]piperazin-1-yl]butan-1-one
CID 110396127
N,N-dimethyl-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]piperazine-1-carboxamide
CID 38131946
2-methyl-1-[4-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]piperazin-1-yl]propan-1-one
CID 110395525
2-[2-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]ethyl]-5-methyl-1,3,4-oxadiazole
CID 110395814

Frequently Asked Questions

What is the IUPAC name of [4-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]-morpholin-4-ylmethanone?
The IUPAC name of [4-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]-morpholin-4-ylmethanone (CID 110395775) is [4-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]-morpholin-4-ylmethanone.
What is the SMILES notation for [4-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]-morpholin-4-ylmethanone?
The canonical SMILES for [4-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]-morpholin-4-ylmethanone is Cc1nnc(CCN2CCN(C(=O)N3CCOCC3)CC2)o1.
What is the InChIKey of [4-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]-morpholin-4-ylmethanone?
The InChIKey is QYHVNERXUBMFBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5O3/c1-12-15-16-13(22-12)2-3-17-4-6-18(7-5-17)14(20)19-8-10-21-11-9-19/h2-11H2,1H3.
What are the key properties of [4-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]-morpholin-4-ylmethanone?
[4-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]-morpholin-4-ylmethanone has a molecular weight of 309.37 g/mol, XLogP of -0.01, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]-morpholin-4-ylmethanone is sourced from PubChem (CID 110395775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).