3-(ethylamino)-N-[1-(2-methoxyacetyl)piperidin-4-yl]propanamide

C13H25N3O3 — CID 62833950

IUPAC3-(ethylamino)-N-[1-(2-methoxyacetyl)piperidin-4-yl]propanamide
SMILESCCNCCC(=O)NC1CCN(C(=O)COC)CC1
InChIInChI=1S/C13H25N3O3/c1-3-14-7-4-12(17)15-11-5-8-16(9-6-11)13(18)10-19-2/h11,14H,3-10H2,1-2H3,(H,15,17)
InChIKeyVOLIVDDSWOSQOH-UHFFFAOYSA-N
MW271.36 g/mol
LogP-0.26
Rot. Bonds7

About 3-(ethylamino)-N-[1-(2-methoxyacetyl)piperidin-4-yl]propanamide

3-(ethylamino)-N-[1-(2-methoxyacetyl)piperidin-4-yl]propanamide (PubChem CID 62833950) has the molecular formula C13H25N3O3 and a molecular weight of 271.36 g/mol. Its IUPAC name is 3-(ethylamino)-N-[1-(2-methoxyacetyl)piperidin-4-yl]propanamide.

Molecular Properties

Compound Name3-(ethylamino)-N-[1-(2-methoxyacetyl)piperidin-4-yl]propanamide
PubChem CID62833950
Molecular FormulaC13H25N3O3
Molecular Weight271.36 g/mol
Exact Mass271.19
IUPAC Name3-(ethylamino)-N-[1-(2-methoxyacetyl)piperidin-4-yl]propanamide
SMILESCCNCCC(=O)NC1CCN(C(=O)COC)CC1
InChIInChI=1S/C13H25N3O3/c1-3-14-7-4-12(17)15-11-5-8-16(9-6-11)13(18)10-19-2/h11,14H,3-10H2,1-2H3,(H,15,17)
InChIKeyVOLIVDDSWOSQOH-UHFFFAOYSA-N
XLogP-0.26
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 5-0.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[1-[3-(ethylamino)propanoyl]piperidin-4-yl]butanamide
CID 62835122
2-bromo-N-[1-(2-methoxyacetyl)piperidin-4-yl]acetamide
CID 63681407
N-[1-(2-methoxyacetyl)piperidin-4-yl]-2-(2,2,2-trifluoroethylamino)acetamide
CID 78958326
1-[4-(ethylaminomethyl)piperidin-1-yl]-2-methoxyethanone;hydrochloride
CID 119645863
3-(ethylamino)-N-(1-ethylsulfonylpiperidin-4-yl)propanamide
CID 62834981
4-[4-[(2-methoxyacetyl)amino]piperidin-1-yl]-4-oxobutanoic acid
CID 54875415
N-[1-(2-bromoacetyl)piperidin-4-yl]-2-methoxyacetamide
CID 63680285
5-[[1-(2-methoxyacetyl)piperidin-4-yl]amino]-3-methyl-5-oxopentanoic acid
CID 62963865
4-amino-N-[1-(2-methoxyacetyl)piperidin-4-yl]-3-methylbutanamide
CID 81076250
2-amino-N-[1-(2-methoxyacetyl)piperidin-4-yl]propanamide
CID 43711839
N-[1-[2-(azetidin-3-yl)acetyl]piperidin-4-yl]-2-methoxyacetamide
CID 64611592
1-amino-N-[1-(2-methoxyacetyl)piperidin-4-yl]cyclobutane-1-carboxamide
CID 81178645

Frequently Asked Questions

What is the IUPAC name of 3-(ethylamino)-N-[1-(2-methoxyacetyl)piperidin-4-yl]propanamide?
The IUPAC name of 3-(ethylamino)-N-[1-(2-methoxyacetyl)piperidin-4-yl]propanamide (CID 62833950) is 3-(ethylamino)-N-[1-(2-methoxyacetyl)piperidin-4-yl]propanamide.
What is the SMILES notation for 3-(ethylamino)-N-[1-(2-methoxyacetyl)piperidin-4-yl]propanamide?
The canonical SMILES for 3-(ethylamino)-N-[1-(2-methoxyacetyl)piperidin-4-yl]propanamide is CCNCCC(=O)NC1CCN(C(=O)COC)CC1.
What is the InChIKey of 3-(ethylamino)-N-[1-(2-methoxyacetyl)piperidin-4-yl]propanamide?
The InChIKey is VOLIVDDSWOSQOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O3/c1-3-14-7-4-12(17)15-11-5-8-16(9-6-11)13(18)10-19-2/h11,14H,3-10H2,1-2H3,(H,15,17).
What are the key properties of 3-(ethylamino)-N-[1-(2-methoxyacetyl)piperidin-4-yl]propanamide?
3-(ethylamino)-N-[1-(2-methoxyacetyl)piperidin-4-yl]propanamide has a molecular weight of 271.36 g/mol, XLogP of -0.26, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethylamino)-N-[1-(2-methoxyacetyl)piperidin-4-yl]propanamide is sourced from PubChem (CID 62833950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).