2-[1-[5-[(propan-2-ylamino)methyl]-1,3,4-oxadiazol-2-yl]piperidin-4-yl]acetamide

C13H23N5O2 — CID 106960185

IUPAC2-[1-[5-[(propan-2-ylamino)methyl]-1,3,4-oxadiazol-2-yl]piperidin-4-yl]acetamide
SMILESCC(C)NCc1nnc(N2CCC(CC(N)=O)CC2)o1
InChIInChI=1S/C13H23N5O2/c1-9(2)15-8-12-16-17-13(20-12)18-5-3-10(4-6-18)7-11(14)19/h9-10,15H,3-8H2,1-2H3,(H2,14,19)
InChIKeyWNDKKOWDZOWXHU-UHFFFAOYSA-N
MW281.36 g/mol
LogP0.66
Rot. Bonds6

About 2-[1-[5-[(propan-2-ylamino)methyl]-1,3,4-oxadiazol-2-yl]piperidin-4-yl]acetamide

2-[1-[5-[(propan-2-ylamino)methyl]-1,3,4-oxadiazol-2-yl]piperidin-4-yl]acetamide (PubChem CID 106960185) has the molecular formula C13H23N5O2 and a molecular weight of 281.36 g/mol. Its IUPAC name is 2-[1-[5-[(propan-2-ylamino)methyl]-1,3,4-oxadiazol-2-yl]piperidin-4-yl]acetamide.

Molecular Properties

Compound Name2-[1-[5-[(propan-2-ylamino)methyl]-1,3,4-oxadiazol-2-yl]piperidin-4-yl]acetamide
PubChem CID106960185
Molecular FormulaC13H23N5O2
Molecular Weight281.36 g/mol
Exact Mass281.19
IUPAC Name2-[1-[5-[(propan-2-ylamino)methyl]-1,3,4-oxadiazol-2-yl]piperidin-4-yl]acetamide
SMILESCC(C)NCc1nnc(N2CCC(CC(N)=O)CC2)o1
InChIInChI=1S/C13H23N5O2/c1-9(2)15-8-12-16-17-13(20-12)18-5-3-10(4-6-18)7-11(14)19/h9-10,15H,3-8H2,1-2H3,(H2,14,19)
InChIKeyWNDKKOWDZOWXHU-UHFFFAOYSA-N
XLogP0.66
TPSA97.28 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 50.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-[1-[5-[(propan-2-ylamino)methyl]-1,3,4-oxadiazol-2-yl]piperidin-4-yl]acetamide with MolForge

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Related Compounds

[1-[5-(ethylaminomethyl)-1,3,4-oxadiazol-2-yl]piperidin-4-yl]methanol
CID 106968380
N-[[5-[3-(methoxymethyl)piperidin-1-yl]-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine
CID 106959508
N-[[5-(4-propylpiperidin-1-yl)-1,3,4-oxadiazol-2-yl]methyl]ethanamine
CID 106960424
2-methyl-N-[[5-(4-propylpiperidin-1-yl)-1,3,4-oxadiazol-2-yl]methyl]propan-1-amine
CID 106960422
1-[5-[(cyclopropylamino)methyl]-1,3,4-oxadiazol-2-yl]piperidine-4-carboxamide
CID 106967817
N-methyl-1-[5-(4-propan-2-ylpiperidin-1-yl)-1,3,4-oxadiazol-2-yl]methanamine
CID 106967346
N-[[5-(4-methylpiperidin-1-yl)-1,3,4-oxadiazol-2-yl]methyl]ethanamine
CID 106967471
N-[[5-(4-propan-2-ylpiperidin-1-yl)-1,3,4-oxadiazol-2-yl]methyl]propan-1-amine
CID 106967348
1-[5-(4-ethylazepan-1-yl)-1,3,4-oxadiazol-2-yl]-N-methylmethanamine
CID 106962399
N-[[5-(3-ethylpyrrolidin-1-yl)-1,3,4-oxadiazol-2-yl]methyl]-2-methylpropan-1-amine
CID 106964439
4-[5-[(propan-2-ylamino)methyl]-1,3,4-oxadiazol-2-yl]-1,4-diazepan-2-one
CID 106961841
2-methyl-N-[[5-(4-methylazepan-1-yl)-1,3,4-oxadiazol-2-yl]methyl]propan-1-amine
CID 106961278

Frequently Asked Questions

What is the IUPAC name of 2-[1-[5-[(propan-2-ylamino)methyl]-1,3,4-oxadiazol-2-yl]piperidin-4-yl]acetamide?
The IUPAC name of 2-[1-[5-[(propan-2-ylamino)methyl]-1,3,4-oxadiazol-2-yl]piperidin-4-yl]acetamide (CID 106960185) is 2-[1-[5-[(propan-2-ylamino)methyl]-1,3,4-oxadiazol-2-yl]piperidin-4-yl]acetamide.
What is the SMILES notation for 2-[1-[5-[(propan-2-ylamino)methyl]-1,3,4-oxadiazol-2-yl]piperidin-4-yl]acetamide?
The canonical SMILES for 2-[1-[5-[(propan-2-ylamino)methyl]-1,3,4-oxadiazol-2-yl]piperidin-4-yl]acetamide is CC(C)NCc1nnc(N2CCC(CC(N)=O)CC2)o1.
What is the InChIKey of 2-[1-[5-[(propan-2-ylamino)methyl]-1,3,4-oxadiazol-2-yl]piperidin-4-yl]acetamide?
The InChIKey is WNDKKOWDZOWXHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N5O2/c1-9(2)15-8-12-16-17-13(20-12)18-5-3-10(4-6-18)7-11(14)19/h9-10,15H,3-8H2,1-2H3,(H2,14,19).
What are the key properties of 2-[1-[5-[(propan-2-ylamino)methyl]-1,3,4-oxadiazol-2-yl]piperidin-4-yl]acetamide?
2-[1-[5-[(propan-2-ylamino)methyl]-1,3,4-oxadiazol-2-yl]piperidin-4-yl]acetamide has a molecular weight of 281.36 g/mol, XLogP of 0.66, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[5-[(propan-2-ylamino)methyl]-1,3,4-oxadiazol-2-yl]piperidin-4-yl]acetamide is sourced from PubChem (CID 106960185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).