2-benzoyl-N-propan-2-yl-8-oxa-2-azaspiro[4.5]decane-4-carboxamide

C19H26N2O3 — CID 118741045

IUPAC2-benzoyl-N-propan-2-yl-8-oxa-2-azaspiro[4.5]decane-4-carboxamide
SMILESCC(C)NC(=O)C1CN(C(=O)c2ccccc2)CC12CCOCC2
InChIInChI=1S/C19H26N2O3/c1-14(2)20-17(22)16-12-21(13-19(16)8-10-24-11-9-19)18(23)15-6-4-3-5-7-15/h3-7,14,16H,8-13H2,1-2H3,(H,20,22)
InChIKeyBMTKZMIJEWNPFO-UHFFFAOYSA-N
MW330.43 g/mol
LogP2.08
Rot. Bonds3

About 2-benzoyl-N-propan-2-yl-8-oxa-2-azaspiro[4.5]decane-4-carboxamide

2-benzoyl-N-propan-2-yl-8-oxa-2-azaspiro[4.5]decane-4-carboxamide (PubChem CID 118741045) has the molecular formula C19H26N2O3 and a molecular weight of 330.43 g/mol. Its IUPAC name is 2-benzoyl-N-propan-2-yl-8-oxa-2-azaspiro[4.5]decane-4-carboxamide.

Molecular Properties

Compound Name2-benzoyl-N-propan-2-yl-8-oxa-2-azaspiro[4.5]decane-4-carboxamide
PubChem CID118741045
Molecular FormulaC19H26N2O3
Molecular Weight330.43 g/mol
Exact Mass330.19
IUPAC Name2-benzoyl-N-propan-2-yl-8-oxa-2-azaspiro[4.5]decane-4-carboxamide
SMILESCC(C)NC(=O)C1CN(C(=O)c2ccccc2)CC12CCOCC2
InChIInChI=1S/C19H26N2O3/c1-14(2)20-17(22)16-12-21(13-19(16)8-10-24-11-9-19)18(23)15-6-4-3-5-7-15/h3-7,14,16H,8-13H2,1-2H3,(H,20,22)
InChIKeyBMTKZMIJEWNPFO-UHFFFAOYSA-N
XLogP2.08
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.43
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-tert-butylbenzoyl)-N-(tetrahydro-2-furanylmethyl)-4-piperidinecarboxamide
CID 2937371
N2-[(4-Fluorophenyl)methyl]-N4,N4-dimethyl-8-oxa-2-azaspiro[4.5]decane-2,4-dicarboxamide
CID 91924909
N-[(1R,5S)-8-(oxolan-2-ylmethyl)-8-azabicyclo[3.2.1]octan-3-yl]benzamide
CID 54768934
(2S,4R)-1-(2-aminoacetyl)-4-benzamido-N-(oxan-4-yl)pyrrolidine-2-carboxamide
CID 16737581
3-(trans-2-((2,2-dimethylpropyl)amino)-cyclopropyl)-N-(tetrahydro-2H-pyran-4-yl)benzamide hydrochloride
CID 118304260
N-cyclopentyl-3-(trans-2-((tetrahydro-2H-pyran-4-ylmethyl)amino)cyclopropyl)-benzamide hydrochloride
CID 118305123
1-benzoyl-N-ethyl-3-methylpyrrolidine-3-carboxamide
CID 46943965
N-{3-[ethyl(tetrahydro-2H-pyran-4-ylmethyl)amino]-3-oxopropyl}-2-fluorobenzamide
CID 50975562
(3,4-Difluorophenyl){4-[(dimethylamino)methyl]-8-oxa-2-azaspiro[4.5]dec-2-yl}methanone
CID 87053373
(2,5-Difluorophenyl){4-[(dimethylamino)methyl]-8-oxa-2-azaspiro[4.5]dec-2-yl}methanone
CID 87053377
N-cyclopropyl-N-(3-fluorobenzyl)-8-oxa-2-azaspiro[4.5]decane-2,4-dicarboxamide
CID 87054508
1-[8-(3-Fluoro-4-methylbenzoyl)-4-(methoxymethyl)-2,8-diazaspiro[4.5]decan-2-YL]ethan-1-one
CID 91910538

Frequently Asked Questions

What is the IUPAC name of 2-benzoyl-N-propan-2-yl-8-oxa-2-azaspiro[4.5]decane-4-carboxamide?
The IUPAC name of 2-benzoyl-N-propan-2-yl-8-oxa-2-azaspiro[4.5]decane-4-carboxamide (CID 118741045) is 2-benzoyl-N-propan-2-yl-8-oxa-2-azaspiro[4.5]decane-4-carboxamide.
What is the SMILES notation for 2-benzoyl-N-propan-2-yl-8-oxa-2-azaspiro[4.5]decane-4-carboxamide?
The canonical SMILES for 2-benzoyl-N-propan-2-yl-8-oxa-2-azaspiro[4.5]decane-4-carboxamide is CC(C)NC(=O)C1CN(C(=O)c2ccccc2)CC12CCOCC2.
What is the InChIKey of 2-benzoyl-N-propan-2-yl-8-oxa-2-azaspiro[4.5]decane-4-carboxamide?
The InChIKey is BMTKZMIJEWNPFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O3/c1-14(2)20-17(22)16-12-21(13-19(16)8-10-24-11-9-19)18(23)15-6-4-3-5-7-15/h3-7,14,16H,8-13H2,1-2H3,(H,20,22).
What are the key properties of 2-benzoyl-N-propan-2-yl-8-oxa-2-azaspiro[4.5]decane-4-carboxamide?
2-benzoyl-N-propan-2-yl-8-oxa-2-azaspiro[4.5]decane-4-carboxamide has a molecular weight of 330.43 g/mol, XLogP of 2.08, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzoyl-N-propan-2-yl-8-oxa-2-azaspiro[4.5]decane-4-carboxamide is sourced from PubChem (CID 118741045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).