N-(2-methoxy-5-piperidin-1-ylphenyl)cyclobutanecarboxamide

C17H24N2O2 — CID 110426214

IUPACN-(2-methoxy-5-piperidin-1-ylphenyl)cyclobutanecarboxamide
SMILESCOc1ccc(N2CCCCC2)cc1NC(=O)C1CCC1
InChIInChI=1S/C17H24N2O2/c1-21-16-9-8-14(19-10-3-2-4-11-19)12-15(16)18-17(20)13-6-5-7-13/h8-9,12-13H,2-7,10-11H2,1H3,(H,18,20)
InChIKeyLEZLGWYWSCDOLG-UHFFFAOYSA-N
MW288.39 g/mol
LogP3.42
Rot. Bonds4

About N-(2-methoxy-5-piperidin-1-ylphenyl)cyclobutanecarboxamide

N-(2-methoxy-5-piperidin-1-ylphenyl)cyclobutanecarboxamide (PubChem CID 110426214) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is N-(2-methoxy-5-piperidin-1-ylphenyl)cyclobutanecarboxamide.

Molecular Properties

Compound NameN-(2-methoxy-5-piperidin-1-ylphenyl)cyclobutanecarboxamide
PubChem CID110426214
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC NameN-(2-methoxy-5-piperidin-1-ylphenyl)cyclobutanecarboxamide
SMILESCOc1ccc(N2CCCCC2)cc1NC(=O)C1CCC1
InChIInChI=1S/C17H24N2O2/c1-21-16-9-8-14(19-10-3-2-4-11-19)12-15(16)18-17(20)13-6-5-7-13/h8-9,12-13H,2-7,10-11H2,1H3,(H,18,20)
InChIKeyLEZLGWYWSCDOLG-UHFFFAOYSA-N
XLogP3.42
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

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Related Compounds

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CID 110361978
2-cyclopropyl-N-(2-methoxy-5-piperidin-1-ylphenyl)propanamide
CID 110613175
3,5-dimethoxy-N-(2-methoxy-5-piperidin-1-ylphenyl)benzamide
CID 110359680
N-(5-bromo-2-methoxyphenyl)cyclooctanecarboxamide
CID 65018183
N-(2-fluoro-5-pyrrolidin-1-ylphenyl)cyclohexanecarboxamide
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N-(5-amino-2-methoxyphenyl)cyclohexanecarboxamide
CID 16773964
N-(2-methoxy-5-piperidin-1-ylphenyl)pentanamide
CID 110359665
N-(2-methoxy-5-piperidin-1-ylphenyl)-2-(oxan-2-yl)acetamide
CID 110613190
N-(5-chloro-2-methoxyphenyl)-1-phenylpiperidine-4-carboxamide
CID 17152311
1-N,3-N-bis(2-methoxy-5-methylphenyl)cyclohexane-1,3-dicarboxamide
CID 60594031
N-(2-methoxy-5-nitrophenyl)cyclohexanecarboxamide
CID 798555
N-[4-[4-(cyclohexanecarbonylamino)-3-methoxyphenyl]-2-methoxyphenyl]cyclohexanecarboxamide
CID 3502281

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-5-piperidin-1-ylphenyl)cyclobutanecarboxamide?
The IUPAC name of N-(2-methoxy-5-piperidin-1-ylphenyl)cyclobutanecarboxamide (CID 110426214) is N-(2-methoxy-5-piperidin-1-ylphenyl)cyclobutanecarboxamide.
What is the SMILES notation for N-(2-methoxy-5-piperidin-1-ylphenyl)cyclobutanecarboxamide?
The canonical SMILES for N-(2-methoxy-5-piperidin-1-ylphenyl)cyclobutanecarboxamide is COc1ccc(N2CCCCC2)cc1NC(=O)C1CCC1.
What is the InChIKey of N-(2-methoxy-5-piperidin-1-ylphenyl)cyclobutanecarboxamide?
The InChIKey is LEZLGWYWSCDOLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-21-16-9-8-14(19-10-3-2-4-11-19)12-15(16)18-17(20)13-6-5-7-13/h8-9,12-13H,2-7,10-11H2,1H3,(H,18,20).
What are the key properties of N-(2-methoxy-5-piperidin-1-ylphenyl)cyclobutanecarboxamide?
N-(2-methoxy-5-piperidin-1-ylphenyl)cyclobutanecarboxamide has a molecular weight of 288.39 g/mol, XLogP of 3.42, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-5-piperidin-1-ylphenyl)cyclobutanecarboxamide is sourced from PubChem (CID 110426214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).