N-[1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-3-yl]formamide

C9H14N4O2 — CID 123875795

IUPACN-[1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-3-yl]formamide
SMILESO=CNC1CCCN(Cc2ncon2)C1
InChIInChI=1S/C9H14N4O2/c14-6-10-8-2-1-3-13(4-8)5-9-11-7-15-12-9/h6-8H,1-5H2,(H,10,14)
InChIKeyZEURZCUHURZLJT-UHFFFAOYSA-N
MW210.24 g/mol
LogP-0.22
Rot. Bonds4

About N-[1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-3-yl]formamide

N-[1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-3-yl]formamide (PubChem CID 123875795) has the molecular formula C9H14N4O2 and a molecular weight of 210.24 g/mol. Its IUPAC name is N-[1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-3-yl]formamide.

Molecular Properties

Compound NameN-[1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-3-yl]formamide
PubChem CID123875795
Molecular FormulaC9H14N4O2
Molecular Weight210.24 g/mol
Exact Mass210.11
IUPAC NameN-[1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-3-yl]formamide
SMILESO=CNC1CCCN(Cc2ncon2)C1
InChIInChI=1S/C9H14N4O2/c14-6-10-8-2-1-3-13(4-8)5-9-11-7-15-12-9/h6-8H,1-5H2,(H,10,14)
InChIKeyZEURZCUHURZLJT-UHFFFAOYSA-N
XLogP-0.22
TPSA71.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.24
LogP ≤ 5-0.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

2-methoxy-N-[[1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-3-yl]methyl]ethanamine
CID 55259133
3-(cyclopropylamino)-1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-2-one
CID 106408298
(3S,4R)-1-(1,2,4-oxadiazol-3-ylmethyl)pyrrolidine-3,4-diol
CID 115278433
N-methyl-1-[1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-4-yl]methanamine
CID 63249054
3-[(3-cyclohexyl-1,4-diazepan-1-yl)methyl]-1,2,4-oxadiazole
CID 106408595
3-(methylamino)-1-(1,2,4-oxadiazol-3-ylmethyl)pyrrolidin-2-one
CID 106402196
4-methoxy-N-[[(3R)-1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-3-yl]methyl]benzenesulfonamide
CID 97268124
N-[[1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-3-yl]methyl]-4-phenylbenzamide
CID 72891106
methyl 2-[4-(1,2,4-oxadiazol-3-ylmethyl)morpholin-2-yl]acetate
CID 115537740
3-[(3S)-1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-3-yl]-N-[4-(trifluoromethyl)phenyl]propanamide
CID 97284094
N-[[1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-3-yl]methyl]quinoline-8-sulfonamide
CID 72878212
3-[2-(3,4,5,7,8,9,10,10a-octahydro-1H-pyrido[1,2-a][1,4]diazepin-2-yl)ethyl]-1,2,4-oxadiazole
CID 106408893

Frequently Asked Questions

What is the IUPAC name of N-[1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-3-yl]formamide?
The IUPAC name of N-[1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-3-yl]formamide (CID 123875795) is N-[1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-3-yl]formamide.
What is the SMILES notation for N-[1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-3-yl]formamide?
The canonical SMILES for N-[1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-3-yl]formamide is O=CNC1CCCN(Cc2ncon2)C1.
What is the InChIKey of N-[1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-3-yl]formamide?
The InChIKey is ZEURZCUHURZLJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4O2/c14-6-10-8-2-1-3-13(4-8)5-9-11-7-15-12-9/h6-8H,1-5H2,(H,10,14).
What are the key properties of N-[1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-3-yl]formamide?
N-[1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-3-yl]formamide has a molecular weight of 210.24 g/mol, XLogP of -0.22, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-3-yl]formamide is sourced from PubChem (CID 123875795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).