2-methyl-2-[(2-piperidin-4-yloxyacetyl)amino]butanamide

C12H23N3O3 — CID 112738157

IUPAC2-methyl-2-[(2-piperidin-4-yloxyacetyl)amino]butanamide
SMILESCCC(C)(NC(=O)COC1CCNCC1)C(N)=O
InChIInChI=1S/C12H23N3O3/c1-3-12(2,11(13)17)15-10(16)8-18-9-4-6-14-7-5-9/h9,14H,3-8H2,1-2H3,(H2,13,17)(H,15,16)
InChIKeyWCLVGGMTSPOMSB-UHFFFAOYSA-N
MW257.33 g/mol
LogP-0.47
Rot. Bonds6

About 2-methyl-2-[(2-piperidin-4-yloxyacetyl)amino]butanamide

2-methyl-2-[(2-piperidin-4-yloxyacetyl)amino]butanamide (PubChem CID 112738157) has the molecular formula C12H23N3O3 and a molecular weight of 257.33 g/mol. Its IUPAC name is 2-methyl-2-[(2-piperidin-4-yloxyacetyl)amino]butanamide.

Molecular Properties

Compound Name2-methyl-2-[(2-piperidin-4-yloxyacetyl)amino]butanamide
PubChem CID112738157
Molecular FormulaC12H23N3O3
Molecular Weight257.33 g/mol
Exact Mass257.17
IUPAC Name2-methyl-2-[(2-piperidin-4-yloxyacetyl)amino]butanamide
SMILESCCC(C)(NC(=O)COC1CCNCC1)C(N)=O
InChIInChI=1S/C12H23N3O3/c1-3-12(2,11(13)17)15-10(16)8-18-9-4-6-14-7-5-9/h9,14H,3-8H2,1-2H3,(H2,13,17)(H,15,16)
InChIKeyWCLVGGMTSPOMSB-UHFFFAOYSA-N
XLogP-0.47
TPSA93.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.33
LogP ≤ 5-0.47
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-methoxy-2-piperidin-4-yloxyacetamide
CID 64975041
propyl 2-piperidin-4-yloxyacetate
CID 63871576
N-hydroxy-2-piperidin-4-yloxyacetamide
CID 63990799
N-(2-aminoethyl)-2-piperidin-4-yloxyacetamide
CID 63876226
2-[(2-methylpropan-2-yl)oxy]ethyl 2-piperidin-4-yloxyacetate
CID 112588078
N-(3-methylbutan-2-yl)-2-piperidin-4-yloxyacetamide
CID 61489309
N-(1-hydroxy-4,4-dimethylpentan-3-yl)-2-piperidin-4-yloxyacetamide
CID 106350056
3-[[(2-piperidin-4-yloxyacetyl)amino]methyl]pentanoic acid
CID 81072441
N-(4-methylcyclohexyl)-2-piperidin-4-yloxyacetamide
CID 63876702
N-[2-(dimethylamino)propyl]-2-piperidin-4-yloxyacetamide
CID 63877258
3-methyl-2-[[(2-piperidin-4-yloxyacetyl)amino]methyl]butanoic acid
CID 65224385
N-[3-(hydroxymethyl)pentan-3-yl]-3-piperidin-4-yloxypropanamide
CID 63905078

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-[(2-piperidin-4-yloxyacetyl)amino]butanamide?
The IUPAC name of 2-methyl-2-[(2-piperidin-4-yloxyacetyl)amino]butanamide (CID 112738157) is 2-methyl-2-[(2-piperidin-4-yloxyacetyl)amino]butanamide.
What is the SMILES notation for 2-methyl-2-[(2-piperidin-4-yloxyacetyl)amino]butanamide?
The canonical SMILES for 2-methyl-2-[(2-piperidin-4-yloxyacetyl)amino]butanamide is CCC(C)(NC(=O)COC1CCNCC1)C(N)=O.
What is the InChIKey of 2-methyl-2-[(2-piperidin-4-yloxyacetyl)amino]butanamide?
The InChIKey is WCLVGGMTSPOMSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O3/c1-3-12(2,11(13)17)15-10(16)8-18-9-4-6-14-7-5-9/h9,14H,3-8H2,1-2H3,(H2,13,17)(H,15,16).
What are the key properties of 2-methyl-2-[(2-piperidin-4-yloxyacetyl)amino]butanamide?
2-methyl-2-[(2-piperidin-4-yloxyacetyl)amino]butanamide has a molecular weight of 257.33 g/mol, XLogP of -0.47, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-[(2-piperidin-4-yloxyacetyl)amino]butanamide is sourced from PubChem (CID 112738157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).