N-[[4-(2-methoxyethoxy)phenyl]methyl]piperidine-2-carboxamide

C16H24N2O3 — CID 119289286

IUPACN-[[4-(2-methoxyethoxy)phenyl]methyl]piperidine-2-carboxamide
SMILESCOCCOc1ccc(CNC(=O)C2CCCCN2)cc1
InChIInChI=1S/C16H24N2O3/c1-20-10-11-21-14-7-5-13(6-8-14)12-18-16(19)15-4-2-3-9-17-15/h5-8,15,17H,2-4,9-12H2,1H3,(H,18,19)
InChIKeyWUYOISZIYRKRQR-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.47
Rot. Bonds7

About N-[[4-(2-methoxyethoxy)phenyl]methyl]piperidine-2-carboxamide

N-[[4-(2-methoxyethoxy)phenyl]methyl]piperidine-2-carboxamide (PubChem CID 119289286) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is N-[[4-(2-methoxyethoxy)phenyl]methyl]piperidine-2-carboxamide.

Molecular Properties

Compound NameN-[[4-(2-methoxyethoxy)phenyl]methyl]piperidine-2-carboxamide
PubChem CID119289286
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC NameN-[[4-(2-methoxyethoxy)phenyl]methyl]piperidine-2-carboxamide
SMILESCOCCOc1ccc(CNC(=O)C2CCCCN2)cc1
InChIInChI=1S/C16H24N2O3/c1-20-10-11-21-14-7-5-13(6-8-14)12-18-16(19)15-4-2-3-9-17-15/h5-8,15,17H,2-4,9-12H2,1H3,(H,18,19)
InChIKeyWUYOISZIYRKRQR-UHFFFAOYSA-N
XLogP1.47
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.47
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-[[4-(2-methoxyethoxy)phenyl]methyl]pyrrolidine-2-carboxamide
CID 119289297
(2R)-N-[[4-[2-(diethylamino)ethoxy]phenyl]methyl]piperidine-2-carboxamide;dihydrochloride
CID 119848309
N-[4-(2-methoxyethoxy)phenyl]piperidine-2-carboxamide
CID 43713427
N-[[4-(2-methoxyethoxy)phenyl]methyl]morpholine-3-carboxamide
CID 119723243
N-[[4-(2-methoxyethoxy)phenyl]methyl]-1,3-thiazolidine-4-carboxamide
CID 110793789
N-[[4-(2-methoxyethylsulfamoyl)phenyl]methyl]piperidine-2-carboxamide
CID 119296308
N-[(4-fluorophenyl)methyl]piperidine-2-carboxamide
CID 11615609
N-[2-(4-methylphenoxy)ethyl]piperidine-2-carboxamide
CID 119266821
N-[[4-(2,2,2-trifluoroethoxy)phenyl]methyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119277640
N-[(4-tert-butylphenyl)methyl]piperidine-2-carboxamide;hydrochloride
CID 119280628
4-[[[(2S)-piperidine-2-carbonyl]amino]methyl]benzoic acid
CID 103869345
N-[3-(4-methylphenoxy)propyl]piperidine-2-carboxamide
CID 119308262

Frequently Asked Questions

What is the IUPAC name of N-[[4-(2-methoxyethoxy)phenyl]methyl]piperidine-2-carboxamide?
The IUPAC name of N-[[4-(2-methoxyethoxy)phenyl]methyl]piperidine-2-carboxamide (CID 119289286) is N-[[4-(2-methoxyethoxy)phenyl]methyl]piperidine-2-carboxamide.
What is the SMILES notation for N-[[4-(2-methoxyethoxy)phenyl]methyl]piperidine-2-carboxamide?
The canonical SMILES for N-[[4-(2-methoxyethoxy)phenyl]methyl]piperidine-2-carboxamide is COCCOc1ccc(CNC(=O)C2CCCCN2)cc1.
What is the InChIKey of N-[[4-(2-methoxyethoxy)phenyl]methyl]piperidine-2-carboxamide?
The InChIKey is WUYOISZIYRKRQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-20-10-11-21-14-7-5-13(6-8-14)12-18-16(19)15-4-2-3-9-17-15/h5-8,15,17H,2-4,9-12H2,1H3,(H,18,19).
What are the key properties of N-[[4-(2-methoxyethoxy)phenyl]methyl]piperidine-2-carboxamide?
N-[[4-(2-methoxyethoxy)phenyl]methyl]piperidine-2-carboxamide has a molecular weight of 292.38 g/mol, XLogP of 1.47, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(2-methoxyethoxy)phenyl]methyl]piperidine-2-carboxamide is sourced from PubChem (CID 119289286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).