2-oxo-N-(4-propoxyphenyl)piperidine-3-carboxamide

C15H20N2O3 — CID 2911661

IUPAC2-oxo-N-(4-propoxyphenyl)piperidine-3-carboxamide
SMILESCCCOc1ccc(NC(=O)C2CCCNC2=O)cc1
InChIInChI=1S/C15H20N2O3/c1-2-10-20-12-7-5-11(6-8-12)17-15(19)13-4-3-9-16-14(13)18/h5-8,13H,2-4,9-10H2,1H3,(H,16,18)(H,17,19)
InChIKeyNXGSJLQAOMKKBY-UHFFFAOYSA-N
MW276.34 g/mol
LogP1.94
Rot. Bonds5

About 2-oxo-N-(4-propoxyphenyl)piperidine-3-carboxamide

2-oxo-N-(4-propoxyphenyl)piperidine-3-carboxamide (PubChem CID 2911661) has the molecular formula C15H20N2O3 and a molecular weight of 276.34 g/mol. Its IUPAC name is 2-oxo-N-(4-propoxyphenyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name2-oxo-N-(4-propoxyphenyl)piperidine-3-carboxamide
PubChem CID2911661
Molecular FormulaC15H20N2O3
Molecular Weight276.34 g/mol
Exact Mass276.15
IUPAC Name2-oxo-N-(4-propoxyphenyl)piperidine-3-carboxamide
SMILESCCCOc1ccc(NC(=O)C2CCCNC2=O)cc1
InChIInChI=1S/C15H20N2O3/c1-2-10-20-12-7-5-11(6-8-12)17-15(19)13-4-3-9-16-14(13)18/h5-8,13H,2-4,9-10H2,1H3,(H,16,18)(H,17,19)
InChIKeyNXGSJLQAOMKKBY-UHFFFAOYSA-N
XLogP1.94
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

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Related Compounds

N-(4-Ethoxyphenyl)-3-oxobutanamide
CID 61053
4-amino-N-[4-(benzyloxy)phenyl]butanamide
CID 22692237
Propetamide
CID 68937
Acetamide, N-(4-butoxyphenyl)-
CID 90165
1-(4-Phenoxyphenyl)-3-(1-propionylpiperidin-4-yl)urea
CID 49783004
1-[1-[(2S)-2-methylbutanoyl]piperidin-4-yl]-3-[4-(trifluoromethoxy)phenyl]urea
CID 71679327
1-(1-(2-Methylbutanoyl)piperidin-4-yl)-3-(4-(trifluoromethoxy)phenyl)urea
CID 71680197
2-methyl-N-(4-phenoxyphenyl)propanamide
CID 874249
N-(4-methoxyphenyl)cyclopentanecarboxamide
CID 531886
Acetamide, N-(4-(3-(4-phenyl-1-piperazinyl)propoxy)phenyl)-
CID 3033717
(2S)-2-amino-N'-(4-phenylmethoxyphenyl)pentanediamide
CID 24901607
(2S)-2-amino-N-(2-aminoethyl)-N''-(4-phenoxyphenyl)pentanediamide
CID 24901635

Frequently Asked Questions

What is the IUPAC name of 2-oxo-N-(4-propoxyphenyl)piperidine-3-carboxamide?
The IUPAC name of 2-oxo-N-(4-propoxyphenyl)piperidine-3-carboxamide (CID 2911661) is 2-oxo-N-(4-propoxyphenyl)piperidine-3-carboxamide.
What is the SMILES notation for 2-oxo-N-(4-propoxyphenyl)piperidine-3-carboxamide?
The canonical SMILES for 2-oxo-N-(4-propoxyphenyl)piperidine-3-carboxamide is CCCOc1ccc(NC(=O)C2CCCNC2=O)cc1.
What is the InChIKey of 2-oxo-N-(4-propoxyphenyl)piperidine-3-carboxamide?
The InChIKey is NXGSJLQAOMKKBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O3/c1-2-10-20-12-7-5-11(6-8-12)17-15(19)13-4-3-9-16-14(13)18/h5-8,13H,2-4,9-10H2,1H3,(H,16,18)(H,17,19).
What are the key properties of 2-oxo-N-(4-propoxyphenyl)piperidine-3-carboxamide?
2-oxo-N-(4-propoxyphenyl)piperidine-3-carboxamide has a molecular weight of 276.34 g/mol, XLogP of 1.94, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-N-(4-propoxyphenyl)piperidine-3-carboxamide is sourced from PubChem (CID 2911661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).