N-[6-(2-methylpropyl)-6-azaspiro[2.5]octan-2-yl]benzamide

C18H26N2O — CID 129116068

IUPACN-[6-(2-methylpropyl)-6-azaspiro[2.5]octan-2-yl]benzamide
SMILESCC(C)CN1CCC2(CC1)CC2NC(=O)c1ccccc1
InChIInChI=1S/C18H26N2O/c1-14(2)13-20-10-8-18(9-11-20)12-16(18)19-17(21)15-6-4-3-5-7-15/h3-7,14,16H,8-13H2,1-2H3,(H,19,21)
InChIKeyGBNGMYKEBFJWOE-UHFFFAOYSA-N
MW286.42 g/mol
LogP2.93
Rot. Bonds4

About N-[6-(2-methylpropyl)-6-azaspiro[2.5]octan-2-yl]benzamide

N-[6-(2-methylpropyl)-6-azaspiro[2.5]octan-2-yl]benzamide (PubChem CID 129116068) has the molecular formula C18H26N2O and a molecular weight of 286.42 g/mol. Its IUPAC name is N-[6-(2-methylpropyl)-6-azaspiro[2.5]octan-2-yl]benzamide.

Molecular Properties

Compound NameN-[6-(2-methylpropyl)-6-azaspiro[2.5]octan-2-yl]benzamide
PubChem CID129116068
Molecular FormulaC18H26N2O
Molecular Weight286.42 g/mol
Exact Mass286.20
IUPAC NameN-[6-(2-methylpropyl)-6-azaspiro[2.5]octan-2-yl]benzamide
SMILESCC(C)CN1CCC2(CC1)CC2NC(=O)c1ccccc1
InChIInChI=1S/C18H26N2O/c1-14(2)13-20-10-8-18(9-11-20)12-16(18)19-17(21)15-6-4-3-5-7-15/h3-7,14,16H,8-13H2,1-2H3,(H,19,21)
InChIKeyGBNGMYKEBFJWOE-UHFFFAOYSA-N
XLogP2.93
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

tert-butyl N-[(2S)-6-phenacyl-6-azaspiro[2.5]octan-2-yl]carbamate
CID 140937019
N-[6-(3-methylbutanoyl)-6-azaspiro[2.5]octan-2-yl]pyridazine-4-carboxamide
CID 169418236
N-[(5S)-9-propan-2-yl-3-oxa-9-azaspiro[5.5]undecan-5-yl]benzamide
CID 97483798
N-[6-(3,3-dimethylbutyl)-6-azaspiro[2.5]octan-2-yl]-3-(trifluoromethyl)benzamide
CID 129116077
N-[6-[2-(methylamino)-2-oxoethyl]-6-azaspiro[2.5]octan-2-yl]-3-(trifluoromethyl)benzamide
CID 163537901
[(2S)-6-(2-methylpropyl)-6-azaspiro[2.5]octan-2-yl]-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]methanone
CID 125155810
2-chloro-N-[(2R)-6-(4-methylpentyl)-6-azaspiro[2.5]octan-2-yl]-5-(trifluoromethyl)benzamide
CID 140937015
N-(9-acetyl-3-oxa-9-azaspiro[5.5]undecan-5-yl)benzamide
CID 131662078
N-[(2R)-6-(2-amino-2-oxoethyl)-6-azaspiro[2.5]octan-2-yl]-3-fluoro-5-(trifluoromethyl)benzamide;2-methylpropane
CID 158391788
N-[1'-(2-methylpropyl)spiro[chromene-2,4'-piperidine]-6-yl]benzamide
CID 25212194
N-methyl-1-(2-methylpropyl)-4-phenoxypiperidine-4-carboxamide
CID 175311415
3-[[4-(2-methylpropyl)piperazin-1-yl]methyl]benzoic acid
CID 62777259

Frequently Asked Questions

What is the IUPAC name of N-[6-(2-methylpropyl)-6-azaspiro[2.5]octan-2-yl]benzamide?
The IUPAC name of N-[6-(2-methylpropyl)-6-azaspiro[2.5]octan-2-yl]benzamide (CID 129116068) is N-[6-(2-methylpropyl)-6-azaspiro[2.5]octan-2-yl]benzamide.
What is the SMILES notation for N-[6-(2-methylpropyl)-6-azaspiro[2.5]octan-2-yl]benzamide?
The canonical SMILES for N-[6-(2-methylpropyl)-6-azaspiro[2.5]octan-2-yl]benzamide is CC(C)CN1CCC2(CC1)CC2NC(=O)c1ccccc1.
What is the InChIKey of N-[6-(2-methylpropyl)-6-azaspiro[2.5]octan-2-yl]benzamide?
The InChIKey is GBNGMYKEBFJWOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O/c1-14(2)13-20-10-8-18(9-11-20)12-16(18)19-17(21)15-6-4-3-5-7-15/h3-7,14,16H,8-13H2,1-2H3,(H,19,21).
What are the key properties of N-[6-(2-methylpropyl)-6-azaspiro[2.5]octan-2-yl]benzamide?
N-[6-(2-methylpropyl)-6-azaspiro[2.5]octan-2-yl]benzamide has a molecular weight of 286.42 g/mol, XLogP of 2.93, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(2-methylpropyl)-6-azaspiro[2.5]octan-2-yl]benzamide is sourced from PubChem (CID 129116068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).