N-benzyl-N,2-dimethyl-8-oxa-2-azaspiro[4.5]decane-4-carboxamide

C18H26N2O2 — CID 87054496

IUPACN-benzyl-N,2-dimethyl-8-oxa-2-azaspiro[4.5]decane-4-carboxamide
SMILESCN1CC(C(=O)N(C)Cc2ccccc2)C2(CCOCC2)C1
InChIInChI=1S/C18H26N2O2/c1-19-13-16(18(14-19)8-10-22-11-9-18)17(21)20(2)12-15-6-4-3-5-7-15/h3-7,16H,8-14H2,1-2H3
InChIKeyFNGVZDVJSJRNSA-UHFFFAOYSA-N
MW302.42 g/mol
LogP2.00
Rot. Bonds3

About N-benzyl-N,2-dimethyl-8-oxa-2-azaspiro[4.5]decane-4-carboxamide

N-benzyl-N,2-dimethyl-8-oxa-2-azaspiro[4.5]decane-4-carboxamide (PubChem CID 87054496) has the molecular formula C18H26N2O2 and a molecular weight of 302.42 g/mol. Its IUPAC name is N-benzyl-N,2-dimethyl-8-oxa-2-azaspiro[4.5]decane-4-carboxamide.

Molecular Properties

Compound NameN-benzyl-N,2-dimethyl-8-oxa-2-azaspiro[4.5]decane-4-carboxamide
PubChem CID87054496
Molecular FormulaC18H26N2O2
Molecular Weight302.42 g/mol
Exact Mass302.20
IUPAC NameN-benzyl-N,2-dimethyl-8-oxa-2-azaspiro[4.5]decane-4-carboxamide
SMILESCN1CC(C(=O)N(C)Cc2ccccc2)C2(CCOCC2)C1
InChIInChI=1S/C18H26N2O2/c1-19-13-16(18(14-19)8-10-22-11-9-18)17(21)20(2)12-15-6-4-3-5-7-15/h3-7,16H,8-14H2,1-2H3
InChIKeyFNGVZDVJSJRNSA-UHFFFAOYSA-N
XLogP2.00
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.42
LogP ≤ 52.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-8-oxa-2-azaspiro[4.5]decane-4-carboxylic acid
CID 121199824
4-amino-N-benzyl-N-methyloxane-4-carboxamide
CID 115293535
7-benzyl-N-(4-hydroxybutyl)-N-methyl-2-oxa-7-azaspiro[4.4]nonane-9-carboxamide
CID 126830281
N-methyl-N-(pyrimidin-2-ylmethyl)-2-(1,3-thiazol-2-ylmethyl)-8-oxa-2-azaspiro[4.5]decane-4-carboxamide
CID 155875192
N-benzyl-9-[(3-fluorophenyl)methyl]-N,4-dimethyl-1-oxa-4,9-diazaspiro[5.5]undecane-2-carboxamide
CID 131669480
N,N-dimethyl-2-(3-methylbutyl)-8-oxa-2-azaspiro[4.5]decane-4-carboxamide
CID 91924730
N-benzyl-9-(cyclopropanecarbonyl)-N,4-dimethyl-1-oxa-4,9-diazaspiro[5.5]undecane-2-carboxamide;2,2,2-trifluoroacetic acid
CID 155860836
N-benzyl-4-(pyrrolidine-1-carbonyl)-8-oxa-2-azaspiro[4.5]decane-2-carboxamide
CID 131651377
(2R)-N-methyl-N-[(2-methyl-1,3-dihydroisoindol-5-yl)methyl]spiro[2.2]pentane-2-carboxamide
CID 126443036
3-[benzyl(methyl)amino]-2-(7-oxaspiro[3.5]nonane-3-carbonylamino)propanoic acid
CID 166317526
N-methyl-N-(pyrimidin-2-ylmethyl)-2-[[5-(trifluoromethyl)-1H-imidazol-2-yl]methyl]-8-oxa-2-azaspiro[4.5]decane-4-carboxamide
CID 131682702
N-benzyl-9-(furan-2-carbonyl)-N,4-dimethyl-1-oxa-4,9-diazaspiro[5.5]undecane-2-carboxamide;2,2,2-trifluoroacetic acid
CID 155860921

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N,2-dimethyl-8-oxa-2-azaspiro[4.5]decane-4-carboxamide?
The IUPAC name of N-benzyl-N,2-dimethyl-8-oxa-2-azaspiro[4.5]decane-4-carboxamide (CID 87054496) is N-benzyl-N,2-dimethyl-8-oxa-2-azaspiro[4.5]decane-4-carboxamide.
What is the SMILES notation for N-benzyl-N,2-dimethyl-8-oxa-2-azaspiro[4.5]decane-4-carboxamide?
The canonical SMILES for N-benzyl-N,2-dimethyl-8-oxa-2-azaspiro[4.5]decane-4-carboxamide is CN1CC(C(=O)N(C)Cc2ccccc2)C2(CCOCC2)C1.
What is the InChIKey of N-benzyl-N,2-dimethyl-8-oxa-2-azaspiro[4.5]decane-4-carboxamide?
The InChIKey is FNGVZDVJSJRNSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O2/c1-19-13-16(18(14-19)8-10-22-11-9-18)17(21)20(2)12-15-6-4-3-5-7-15/h3-7,16H,8-14H2,1-2H3.
What are the key properties of N-benzyl-N,2-dimethyl-8-oxa-2-azaspiro[4.5]decane-4-carboxamide?
N-benzyl-N,2-dimethyl-8-oxa-2-azaspiro[4.5]decane-4-carboxamide has a molecular weight of 302.42 g/mol, XLogP of 2.00, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N,2-dimethyl-8-oxa-2-azaspiro[4.5]decane-4-carboxamide is sourced from PubChem (CID 87054496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).