N-(4-chlorophenyl)-1-oxa-4-azaspiro[4.5]decane-4-carboxamide

C15H19ClN2O2 — CID 1472890

IUPACN-(4-chlorophenyl)-1-oxa-4-azaspiro[4.5]decane-4-carboxamide
SMILESO=C(Nc1ccc(Cl)cc1)N1CCOC12CCCCC2
InChIInChI=1S/C15H19ClN2O2/c16-12-4-6-13(7-5-12)17-14(19)18-10-11-20-15(18)8-2-1-3-9-15/h4-7H,1-3,8-11H2,(H,17,19)
InChIKeyMXFSDTDLBBWLFQ-UHFFFAOYSA-N
MW294.78 g/mol
LogP3.86
Rot. Bonds1

About N-(4-chlorophenyl)-1-oxa-4-azaspiro[4.5]decane-4-carboxamide

N-(4-chlorophenyl)-1-oxa-4-azaspiro[4.5]decane-4-carboxamide (PubChem CID 1472890) has the molecular formula C15H19ClN2O2 and a molecular weight of 294.78 g/mol. Its IUPAC name is N-(4-chlorophenyl)-1-oxa-4-azaspiro[4.5]decane-4-carboxamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-1-oxa-4-azaspiro[4.5]decane-4-carboxamide
PubChem CID1472890
Molecular FormulaC15H19ClN2O2
Molecular Weight294.78 g/mol
Exact Mass294.11
IUPAC NameN-(4-chlorophenyl)-1-oxa-4-azaspiro[4.5]decane-4-carboxamide
SMILESO=C(Nc1ccc(Cl)cc1)N1CCOC12CCCCC2
InChIInChI=1S/C15H19ClN2O2/c16-12-4-6-13(7-5-12)17-14(19)18-10-11-20-15(18)8-2-1-3-9-15/h4-7H,1-3,8-11H2,(H,17,19)
InChIKeyMXFSDTDLBBWLFQ-UHFFFAOYSA-N
XLogP3.86
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.78
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-1-oxa-4-azaspiro[4.5]decane-4-carboxamide?
The IUPAC name of N-(4-chlorophenyl)-1-oxa-4-azaspiro[4.5]decane-4-carboxamide (CID 1472890) is N-(4-chlorophenyl)-1-oxa-4-azaspiro[4.5]decane-4-carboxamide.
What is the SMILES notation for N-(4-chlorophenyl)-1-oxa-4-azaspiro[4.5]decane-4-carboxamide?
The canonical SMILES for N-(4-chlorophenyl)-1-oxa-4-azaspiro[4.5]decane-4-carboxamide is O=C(Nc1ccc(Cl)cc1)N1CCOC12CCCCC2.
What is the InChIKey of N-(4-chlorophenyl)-1-oxa-4-azaspiro[4.5]decane-4-carboxamide?
The InChIKey is MXFSDTDLBBWLFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19ClN2O2/c16-12-4-6-13(7-5-12)17-14(19)18-10-11-20-15(18)8-2-1-3-9-15/h4-7H,1-3,8-11H2,(H,17,19).
What are the key properties of N-(4-chlorophenyl)-1-oxa-4-azaspiro[4.5]decane-4-carboxamide?
N-(4-chlorophenyl)-1-oxa-4-azaspiro[4.5]decane-4-carboxamide has a molecular weight of 294.78 g/mol, XLogP of 3.86, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-1-oxa-4-azaspiro[4.5]decane-4-carboxamide is sourced from PubChem (CID 1472890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).