N-methoxy-1-(3-phenoxypropanoyl)piperidine-3-carboxamide

C16H22N2O4 — CID 60562165

IUPACN-methoxy-1-(3-phenoxypropanoyl)piperidine-3-carboxamide
SMILESCONC(=O)C1CCCN(C(=O)CCOc2ccccc2)C1
InChIInChI=1S/C16H22N2O4/c1-21-17-16(20)13-6-5-10-18(12-13)15(19)9-11-22-14-7-3-2-4-8-14/h2-4,7-8,13H,5-6,9-12H2,1H3,(H,17,20)
InChIKeyYUZSADIYGIDUIB-UHFFFAOYSA-N
MW306.36 g/mol
LogP1.37
Rot. Bonds6

About N-methoxy-1-(3-phenoxypropanoyl)piperidine-3-carboxamide

N-methoxy-1-(3-phenoxypropanoyl)piperidine-3-carboxamide (PubChem CID 60562165) has the molecular formula C16H22N2O4 and a molecular weight of 306.36 g/mol. Its IUPAC name is N-methoxy-1-(3-phenoxypropanoyl)piperidine-3-carboxamide.

Molecular Properties

Compound NameN-methoxy-1-(3-phenoxypropanoyl)piperidine-3-carboxamide
PubChem CID60562165
Molecular FormulaC16H22N2O4
Molecular Weight306.36 g/mol
Exact Mass306.16
IUPAC NameN-methoxy-1-(3-phenoxypropanoyl)piperidine-3-carboxamide
SMILESCONC(=O)C1CCCN(C(=O)CCOc2ccccc2)C1
InChIInChI=1S/C16H22N2O4/c1-21-17-16(20)13-6-5-10-18(12-13)15(19)9-11-22-14-7-3-2-4-8-14/h2-4,7-8,13H,5-6,9-12H2,1H3,(H,17,20)
InChIKeyYUZSADIYGIDUIB-UHFFFAOYSA-N
XLogP1.37
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.36
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-methoxy-1-(3-phenoxypropanoyl)piperidine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-amino-2-methylpropyl)-1-(3-phenoxypropanoyl)piperidine-3-carboxamide
CID 119629786
ethyl 2-[[1-(3-phenoxypropanoyl)piperidine-3-carbonyl]amino]propanoate
CID 47078434
(3S)-N-[2-(cyclopropylamino)-2-oxoethyl]-1-(3-phenoxypropanoyl)piperidine-3-carboxamide
CID 52504687
N-[(2R)-2-(ethylamino)propyl]-1-(3-phenoxypropanoyl)piperidine-3-carboxamide
CID 120651023
cis-(1S,3R)-3-[[1-(3-phenoxypropanoyl)piperidine-3-carbonyl]amino]cyclopentane-1-carboxylic acid
CID 120674902
N-(2-ethylcyclohexyl)-1-(3-phenoxypropanoyl)piperidine-3-carboxamide
CID 60553205
1-[3-[4-(cyclobutanecarbonyl)piperazine-1-carbonyl]piperidin-1-yl]-3-phenoxypropan-1-one
CID 56512509
methyl 1-(3-phenoxypropanoyl)pyrrolidine-3-carboxylate
CID 84581076
1-[3-(4-aminopiperidine-1-carbonyl)piperidin-1-yl]-3-phenoxypropan-1-one
CID 119376198
N-[4-(diethylamino)phenyl]-1-(3-phenoxypropanoyl)piperidine-3-carboxamide
CID 60553985
1-(3-phenoxypropanoyl)-N-[2-(2,2,2-trifluoroethoxy)ethyl]piperidine-3-carboxamide
CID 55965390
2-[2-[[1-(3-phenoxypropanoyl)piperidine-3-carbonyl]amino]ethylsulfanyl]acetic acid
CID 119242294

Frequently Asked Questions

What is the IUPAC name of N-methoxy-1-(3-phenoxypropanoyl)piperidine-3-carboxamide?
The IUPAC name of N-methoxy-1-(3-phenoxypropanoyl)piperidine-3-carboxamide (CID 60562165) is N-methoxy-1-(3-phenoxypropanoyl)piperidine-3-carboxamide.
What is the SMILES notation for N-methoxy-1-(3-phenoxypropanoyl)piperidine-3-carboxamide?
The canonical SMILES for N-methoxy-1-(3-phenoxypropanoyl)piperidine-3-carboxamide is CONC(=O)C1CCCN(C(=O)CCOc2ccccc2)C1.
What is the InChIKey of N-methoxy-1-(3-phenoxypropanoyl)piperidine-3-carboxamide?
The InChIKey is YUZSADIYGIDUIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O4/c1-21-17-16(20)13-6-5-10-18(12-13)15(19)9-11-22-14-7-3-2-4-8-14/h2-4,7-8,13H,5-6,9-12H2,1H3,(H,17,20).
What are the key properties of N-methoxy-1-(3-phenoxypropanoyl)piperidine-3-carboxamide?
N-methoxy-1-(3-phenoxypropanoyl)piperidine-3-carboxamide has a molecular weight of 306.36 g/mol, XLogP of 1.37, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-1-(3-phenoxypropanoyl)piperidine-3-carboxamide is sourced from PubChem (CID 60562165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).