N-[1-(2-methoxyacetyl)piperidin-4-yl]-2-(4-propan-2-ylphenoxy)propanamide

C20H30N2O4 — CID 108553340

IUPACN-[1-(2-methoxyacetyl)piperidin-4-yl]-2-(4-propan-2-ylphenoxy)propanamide
SMILESCOCC(=O)N1CCC(NC(=O)C(C)Oc2ccc(C(C)C)cc2)CC1
InChIInChI=1S/C20H30N2O4/c1-14(2)16-5-7-18(8-6-16)26-15(3)20(24)21-17-9-11-22(12-10-17)19(23)13-25-4/h5-8,14-15,17H,9-13H2,1-4H3,(H,21,24)
InChIKeyRTTOORFIEYTESG-UHFFFAOYSA-N
MW362.47 g/mol
LogP2.33
Rot. Bonds7

About N-[1-(2-methoxyacetyl)piperidin-4-yl]-2-(4-propan-2-ylphenoxy)propanamide

N-[1-(2-methoxyacetyl)piperidin-4-yl]-2-(4-propan-2-ylphenoxy)propanamide (PubChem CID 108553340) has the molecular formula C20H30N2O4 and a molecular weight of 362.47 g/mol. Its IUPAC name is N-[1-(2-methoxyacetyl)piperidin-4-yl]-2-(4-propan-2-ylphenoxy)propanamide.

Molecular Properties

Compound NameN-[1-(2-methoxyacetyl)piperidin-4-yl]-2-(4-propan-2-ylphenoxy)propanamide
PubChem CID108553340
Molecular FormulaC20H30N2O4
Molecular Weight362.47 g/mol
Exact Mass362.22
IUPAC NameN-[1-(2-methoxyacetyl)piperidin-4-yl]-2-(4-propan-2-ylphenoxy)propanamide
SMILESCOCC(=O)N1CCC(NC(=O)C(C)Oc2ccc(C(C)C)cc2)CC1
InChIInChI=1S/C20H30N2O4/c1-14(2)16-5-7-18(8-6-16)26-15(3)20(24)21-17-9-11-22(12-10-17)19(23)13-25-4/h5-8,14-15,17H,9-13H2,1-4H3,(H,21,24)
InChIKeyRTTOORFIEYTESG-UHFFFAOYSA-N
XLogP2.33
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.47
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-propan-2-ylphenoxy)-N-[1-(2-thiophen-2-ylacetyl)piperidin-4-yl]propanamide
CID 108553319
2-(4-chlorophenoxy)-N-[1-(3-methoxypropanoyl)piperidin-4-yl]propanamide
CID 108553182
2-(4-hydroxyphenoxy)-N-[1-(4-propan-2-ylbenzoyl)piperidin-4-yl]propanamide
CID 108560077
3-methoxy-N-[1-[2-(4-propan-2-ylphenoxy)propanoyl]piperidin-4-yl]propanamide
CID 108556193
N-[1-(3-methoxybenzoyl)piperidin-4-yl]-2-(4-propan-2-ylphenoxy)propanamide
CID 108553309
N-[1-(6-oxo-1H-pyridazine-3-carbonyl)piperidin-4-yl]-2-(4-propan-2-ylphenoxy)propanamide
CID 108553323
N-[1-(3-chloropropanoyl)piperidin-4-yl]-2-(4-hydroxyphenoxy)propanamide
CID 108560062
3-methyl-N-[1-[2-(4-propan-2-ylphenoxy)propanoyl]piperidin-4-yl]butanamide
CID 108549550
2-(4-chlorophenoxy)-N-[1-[2-(2,4-dimethylphenoxy)acetyl]piperidin-4-yl]propanamide
CID 108553151
2-amino-N-[1-(2-methoxyacetyl)piperidin-4-yl]propanamide
CID 43711839
3,3-dimethyl-N-[1-[2-(4-propan-2-ylphenoxy)propanoyl]piperidin-4-yl]butanamide
CID 108565276
2-methoxy-1-[4-[1-(4-methylphenyl)ethylamino]piperidin-1-yl]ethanone
CID 43747615

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-methoxyacetyl)piperidin-4-yl]-2-(4-propan-2-ylphenoxy)propanamide?
The IUPAC name of N-[1-(2-methoxyacetyl)piperidin-4-yl]-2-(4-propan-2-ylphenoxy)propanamide (CID 108553340) is N-[1-(2-methoxyacetyl)piperidin-4-yl]-2-(4-propan-2-ylphenoxy)propanamide.
What is the SMILES notation for N-[1-(2-methoxyacetyl)piperidin-4-yl]-2-(4-propan-2-ylphenoxy)propanamide?
The canonical SMILES for N-[1-(2-methoxyacetyl)piperidin-4-yl]-2-(4-propan-2-ylphenoxy)propanamide is COCC(=O)N1CCC(NC(=O)C(C)Oc2ccc(C(C)C)cc2)CC1.
What is the InChIKey of N-[1-(2-methoxyacetyl)piperidin-4-yl]-2-(4-propan-2-ylphenoxy)propanamide?
The InChIKey is RTTOORFIEYTESG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N2O4/c1-14(2)16-5-7-18(8-6-16)26-15(3)20(24)21-17-9-11-22(12-10-17)19(23)13-25-4/h5-8,14-15,17H,9-13H2,1-4H3,(H,21,24).
What are the key properties of N-[1-(2-methoxyacetyl)piperidin-4-yl]-2-(4-propan-2-ylphenoxy)propanamide?
N-[1-(2-methoxyacetyl)piperidin-4-yl]-2-(4-propan-2-ylphenoxy)propanamide has a molecular weight of 362.47 g/mol, XLogP of 2.33, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-methoxyacetyl)piperidin-4-yl]-2-(4-propan-2-ylphenoxy)propanamide is sourced from PubChem (CID 108553340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).