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

C13H23N5O2 — CID 61497293

IUPAC2-[piperidin-4-yl-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]amino]acetamide
SMILESCC(C)c1nc(CN(CC(N)=O)C2CCNCC2)no1
InChIInChI=1S/C13H23N5O2/c1-9(2)13-16-12(17-20-13)8-18(7-11(14)19)10-3-5-15-6-4-10/h9-10,15H,3-8H2,1-2H3,(H2,14,19)
InChIKeyNOYFICSAAQMIDN-UHFFFAOYSA-N
MW281.36 g/mol
LogP0.23
Rot. Bonds6

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

2-[piperidin-4-yl-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]amino]acetamide (PubChem CID 61497293) has the molecular formula C13H23N5O2 and a molecular weight of 281.36 g/mol. Its IUPAC name is 2-[piperidin-4-yl-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]amino]acetamide.

Molecular Properties

Compound Name2-[piperidin-4-yl-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]amino]acetamide
PubChem CID61497293
Molecular FormulaC13H23N5O2
Molecular Weight281.36 g/mol
Exact Mass281.19
IUPAC Name2-[piperidin-4-yl-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]amino]acetamide
SMILESCC(C)c1nc(CN(CC(N)=O)C2CCNCC2)no1
InChIInChI=1S/C13H23N5O2/c1-9(2)13-16-12(17-20-13)8-18(7-11(14)19)10-3-5-15-6-4-10/h9-10,15H,3-8H2,1-2H3,(H2,14,19)
InChIKeyNOYFICSAAQMIDN-UHFFFAOYSA-N
XLogP0.23
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 ≤ 50.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(piperidin-4-ylmethyl)-N-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]cyclopropanamine
CID 79713790
N-methyl-N-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]piperidin-4-amine;hydrochloride
CID 119912855
2-[piperidin-4-yl(1,3-thiazol-5-ylmethyl)amino]acetamide
CID 112641538
N-ethyl-N-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]-8-azabicyclo[3.2.1]octan-3-amine
CID 61497415
2-[(3-methyl-2-pyridinyl)methyl-piperidin-4-ylamino]acetamide
CID 112650951
2-[[2-[cyclopropyl(methyl)amino]-2-oxoethyl]-piperidin-4-ylamino]acetamide
CID 61489246
2-[(5-methyl-3-pyridinyl)methyl-piperidin-4-ylamino]acetamide
CID 102877705
1-piperazin-1-yl-2-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)ethanone
CID 82511042
N-[(2-nitrophenyl)methyl]-N-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]cyclopropanamine
CID 75386873
2-[2,3-dihydroxypropyl(piperidin-4-yl)amino]acetamide
CID 82849875
2-[(2-oxo-1,3-oxazolidin-5-yl)methyl-piperidin-4-ylamino]acetamide
CID 54923799
N-[(2,5-dimethoxyphenyl)methyl]-N-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]cyclopropanamine
CID 47070103

Frequently Asked Questions

What is the IUPAC name of 2-[piperidin-4-yl-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]amino]acetamide?
The IUPAC name of 2-[piperidin-4-yl-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]amino]acetamide (CID 61497293) is 2-[piperidin-4-yl-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]amino]acetamide.
What is the SMILES notation for 2-[piperidin-4-yl-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]amino]acetamide?
The canonical SMILES for 2-[piperidin-4-yl-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]amino]acetamide is CC(C)c1nc(CN(CC(N)=O)C2CCNCC2)no1.
What is the InChIKey of 2-[piperidin-4-yl-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]amino]acetamide?
The InChIKey is NOYFICSAAQMIDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N5O2/c1-9(2)13-16-12(17-20-13)8-18(7-11(14)19)10-3-5-15-6-4-10/h9-10,15H,3-8H2,1-2H3,(H2,14,19).
What are the key properties of 2-[piperidin-4-yl-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]amino]acetamide?
2-[piperidin-4-yl-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]amino]acetamide has a molecular weight of 281.36 g/mol, XLogP of 0.23, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[piperidin-4-yl-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]amino]acetamide is sourced from PubChem (CID 61497293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).