N-cyclohexyl-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-phenylacetamide

C21H30N2O3 — CID 3245900

IUPACN-cyclohexyl-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-phenylacetamide
SMILESO=C(NC1CCCCC1)C(c1ccccc1)N1CCC2(CC1)OCCO2
InChIInChI=1S/C21H30N2O3/c24-20(22-18-9-5-2-6-10-18)19(17-7-3-1-4-8-17)23-13-11-21(12-14-23)25-15-16-26-21/h1,3-4,7-8,18-19H,2,5-6,9-16H2,(H,22,24)
InChIKeyJKWIZPLNSDXSNA-UHFFFAOYSA-N
MW358.48 g/mol
LogP3.02
Rot. Bonds4

About N-cyclohexyl-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-phenylacetamide

N-cyclohexyl-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-phenylacetamide (PubChem CID 3245900) has the molecular formula C21H30N2O3 and a molecular weight of 358.48 g/mol. Its IUPAC name is N-cyclohexyl-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-phenylacetamide.

Molecular Properties

Compound NameN-cyclohexyl-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-phenylacetamide
PubChem CID3245900
Molecular FormulaC21H30N2O3
Molecular Weight358.48 g/mol
Exact Mass358.23
IUPAC NameN-cyclohexyl-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-phenylacetamide
SMILESO=C(NC1CCCCC1)C(c1ccccc1)N1CCC2(CC1)OCCO2
InChIInChI=1S/C21H30N2O3/c24-20(22-18-9-5-2-6-10-18)19(17-7-3-1-4-8-17)23-13-11-21(12-14-23)25-15-16-26-21/h1,3-4,7-8,18-19H,2,5-6,9-16H2,(H,22,24)
InChIKeyJKWIZPLNSDXSNA-UHFFFAOYSA-N
XLogP3.02
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.48
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclohexyl-2-[(2,2-dimethoxyethyl)(methyl)amino]-2-phenylacetamide
CID 4595109
N-cyclohexyl-2-phenyl-2-pyrrolidin-1-ylacetamide
CID 3237691
N-cyclohexyl-2-morpholin-4-yl-2-phenylacetamide
CID 3240341
N-(1-morpholin-4-yl-1-phenylpropan-2-yl)-2-phenylacetamide
CID 3500492
N-[2-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)-2-oxoethyl]-2-[1-oxo-2(1H)-isoquinolinyl]acetamide
CID 4197881
2-(4-Chlorophenyl)-N~1~-cyclohexyl-2-(1,4-dioxa-8-azaspiro[4.5]dec-8-YL)acetamide
CID 4594941
N-{[Methyl-((S)-1-phenyl-2-pyrrolidin-1-yl-ethyl)-carbamoyl]-methyl}-2-phenyl-acetamide
CID 44389972
methyl N-[(1S)-2-[methyl-[(1S)-1-phenyl-2-pyrrolidin-1-ylethyl]amino]-2-oxo-1-phenylethyl]carbamate
CID 44389992
methyl N-[(1S)-2-[methyl-[(1R)-1-phenyl-2-pyrrolidin-1-ylethyl]amino]-2-oxo-1-phenylethyl]carbamate
CID 44577285
1-Piperidineacetamide, alpha-phenyl-N-(2-(1-pyrrolidinyl)ethyl)-
CID 3052196
N-cyclohexyl-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-(4-methylphenyl)acetamide
CID 4594938
N-(3-ethoxypropyl)-2-(4-methylphenyl)-2-morpholin-4-ylacetamide
CID 4644536

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-phenylacetamide?
The IUPAC name of N-cyclohexyl-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-phenylacetamide (CID 3245900) is N-cyclohexyl-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-phenylacetamide.
What is the SMILES notation for N-cyclohexyl-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-phenylacetamide?
The canonical SMILES for N-cyclohexyl-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-phenylacetamide is O=C(NC1CCCCC1)C(c1ccccc1)N1CCC2(CC1)OCCO2.
What is the InChIKey of N-cyclohexyl-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-phenylacetamide?
The InChIKey is JKWIZPLNSDXSNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H30N2O3/c24-20(22-18-9-5-2-6-10-18)19(17-7-3-1-4-8-17)23-13-11-21(12-14-23)25-15-16-26-21/h1,3-4,7-8,18-19H,2,5-6,9-16H2,(H,22,24).
What are the key properties of N-cyclohexyl-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-phenylacetamide?
N-cyclohexyl-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-phenylacetamide has a molecular weight of 358.48 g/mol, XLogP of 3.02, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-phenylacetamide is sourced from PubChem (CID 3245900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).