N-(3-methylbut-2-enyl)-2-piperidin-4-yloxyacetamide

C12H22N2O2 — CID 106186805

IUPACN-(3-methylbut-2-enyl)-2-piperidin-4-yloxyacetamide
SMILESCC(C)=CCNC(=O)COC1CCNCC1
InChIInChI=1S/C12H22N2O2/c1-10(2)3-8-14-12(15)9-16-11-4-6-13-7-5-11/h3,11,13H,4-9H2,1-2H3,(H,14,15)
InChIKeySLFXKIQJZBQLPW-UHFFFAOYSA-N
MW226.32 g/mol
LogP0.84
Rot. Bonds5

About N-(3-methylbut-2-enyl)-2-piperidin-4-yloxyacetamide

N-(3-methylbut-2-enyl)-2-piperidin-4-yloxyacetamide (PubChem CID 106186805) has the molecular formula C12H22N2O2 and a molecular weight of 226.32 g/mol. Its IUPAC name is N-(3-methylbut-2-enyl)-2-piperidin-4-yloxyacetamide.

Molecular Properties

Compound NameN-(3-methylbut-2-enyl)-2-piperidin-4-yloxyacetamide
PubChem CID106186805
Molecular FormulaC12H22N2O2
Molecular Weight226.32 g/mol
Exact Mass226.17
IUPAC NameN-(3-methylbut-2-enyl)-2-piperidin-4-yloxyacetamide
SMILESCC(C)=CCNC(=O)COC1CCNCC1
InChIInChI=1S/C12H22N2O2/c1-10(2)3-8-14-12(15)9-16-11-4-6-13-7-5-11/h3,11,13H,4-9H2,1-2H3,(H,14,15)
InChIKeySLFXKIQJZBQLPW-UHFFFAOYSA-N
XLogP0.84
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 50.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-Ethyl-2-(4-piperidinyloxy)acetamide
CID 20298099
2-piperidin-4-yloxy-1-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]ethanone
CID 114489787
N-butyl-2-piperidin-4-yloxyacetamide
CID 20298119
2-methyl-N-(2-morpholin-2-ylethyl)prop-2-enamide
CID 68133256
2-(4-Piperidinyloxy)-N-propylacetamide
CID 24208844
2-piperidin-4-yloxy-N-prop-2-enylpropanamide
CID 43346265
N-(2-methylpropyl)-2-piperidin-4-yloxyacetamide
CID 43346285
2-piperidin-4-yloxy-N-prop-2-enylacetamide
CID 43346294
2-methoxy-N-[1-(3-methylbut-2-enyl)piperidin-4-yl]acetamide
CID 53515103
2-methoxy-N-[1-(2-methylprop-2-enyl)piperidin-4-yl]acetamide
CID 53520284
3-methyl-N-(3-piperidin-4-yloxypropyl)but-2-enamide
CID 55251214
3-Methyl-1-(2-piperidin-4-yloxyethyl)pyrrole-2,5-dione
CID 55251420

Frequently Asked Questions

What is the IUPAC name of N-(3-methylbut-2-enyl)-2-piperidin-4-yloxyacetamide?
The IUPAC name of N-(3-methylbut-2-enyl)-2-piperidin-4-yloxyacetamide (CID 106186805) is N-(3-methylbut-2-enyl)-2-piperidin-4-yloxyacetamide.
What is the SMILES notation for N-(3-methylbut-2-enyl)-2-piperidin-4-yloxyacetamide?
The canonical SMILES for N-(3-methylbut-2-enyl)-2-piperidin-4-yloxyacetamide is CC(C)=CCNC(=O)COC1CCNCC1.
What is the InChIKey of N-(3-methylbut-2-enyl)-2-piperidin-4-yloxyacetamide?
The InChIKey is SLFXKIQJZBQLPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2/c1-10(2)3-8-14-12(15)9-16-11-4-6-13-7-5-11/h3,11,13H,4-9H2,1-2H3,(H,14,15).
What are the key properties of N-(3-methylbut-2-enyl)-2-piperidin-4-yloxyacetamide?
N-(3-methylbut-2-enyl)-2-piperidin-4-yloxyacetamide has a molecular weight of 226.32 g/mol, XLogP of 0.84, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylbut-2-enyl)-2-piperidin-4-yloxyacetamide is sourced from PubChem (CID 106186805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).