N-(1-oxaspiro[5.5]undecan-4-yl)-2-(1,2-oxazol-3-yl)acetamide

C15H22N2O3 — CID 71968225

IUPACN-(1-oxaspiro[5.5]undecan-4-yl)-2-(1,2-oxazol-3-yl)acetamide
SMILESO=C(Cc1ccon1)NC1CCOC2(CCCCC2)C1
InChIInChI=1S/C15H22N2O3/c18-14(10-12-5-9-20-17-12)16-13-4-8-19-15(11-13)6-2-1-3-7-15/h5,9,13H,1-4,6-8,10-11H2,(H,16,18)
InChIKeyBHQAIDSJFWGVLT-UHFFFAOYSA-N
MW278.35 g/mol
LogP2.22
Rot. Bonds3

About N-(1-oxaspiro[5.5]undecan-4-yl)-2-(1,2-oxazol-3-yl)acetamide

N-(1-oxaspiro[5.5]undecan-4-yl)-2-(1,2-oxazol-3-yl)acetamide (PubChem CID 71968225) has the molecular formula C15H22N2O3 and a molecular weight of 278.35 g/mol. Its IUPAC name is N-(1-oxaspiro[5.5]undecan-4-yl)-2-(1,2-oxazol-3-yl)acetamide.

Molecular Properties

Compound NameN-(1-oxaspiro[5.5]undecan-4-yl)-2-(1,2-oxazol-3-yl)acetamide
PubChem CID71968225
Molecular FormulaC15H22N2O3
Molecular Weight278.35 g/mol
Exact Mass278.16
IUPAC NameN-(1-oxaspiro[5.5]undecan-4-yl)-2-(1,2-oxazol-3-yl)acetamide
SMILESO=C(Cc1ccon1)NC1CCOC2(CCCCC2)C1
InChIInChI=1S/C15H22N2O3/c18-14(10-12-5-9-20-17-12)16-13-4-8-19-15(11-13)6-2-1-3-7-15/h5,9,13H,1-4,6-8,10-11H2,(H,16,18)
InChIKeyBHQAIDSJFWGVLT-UHFFFAOYSA-N
XLogP2.22
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,2-dimethyloxan-4-yl)-2-(1,2-oxazol-3-yl)acetamide
CID 136517618
N-(1-oxaspiro[5.5]undecan-4-yl)acetamide
CID 51358556
2-(2-methoxyanilino)-N-(1-oxaspiro[5.5]undecan-4-yl)acetamide
CID 86769703
N-(1,9-dioxaspiro[5.5]undecan-4-yl)-2-pyridin-3-ylacetamide
CID 77087174
6-oxaspiro[4.5]decan-9-ylurea
CID 127598348
(2S)-2-hydroxy-N-[(4R)-1-oxaspiro[5.5]undecan-4-yl]-2-phenylacetamide
CID 97235901
1-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]-3-(1-oxaspiro[5.5]undecan-4-yl)urea
CID 139009735
1-[(2S)-2-(furan-2-yl)-2-hydroxypropyl]-3-[(4S)-1-oxaspiro[5.5]undecan-4-yl]urea
CID 99775994
1-[2-(6-methyl-3-pyridinyl)ethyl]-3-[(4S)-1-oxaspiro[5.5]undecan-4-yl]urea
CID 97235565
2-[5-(4-methylphenyl)tetrazol-2-yl]-N-(6-oxaspiro[4.5]decan-9-yl)acetamide
CID 136516066
5-oxaspiro[3.5]nonan-8-ylurea
CID 131086736
3,6-dimethyl-N-(1-oxaspiro[5.5]undecan-4-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 71847295

Frequently Asked Questions

What is the IUPAC name of N-(1-oxaspiro[5.5]undecan-4-yl)-2-(1,2-oxazol-3-yl)acetamide?
The IUPAC name of N-(1-oxaspiro[5.5]undecan-4-yl)-2-(1,2-oxazol-3-yl)acetamide (CID 71968225) is N-(1-oxaspiro[5.5]undecan-4-yl)-2-(1,2-oxazol-3-yl)acetamide.
What is the SMILES notation for N-(1-oxaspiro[5.5]undecan-4-yl)-2-(1,2-oxazol-3-yl)acetamide?
The canonical SMILES for N-(1-oxaspiro[5.5]undecan-4-yl)-2-(1,2-oxazol-3-yl)acetamide is O=C(Cc1ccon1)NC1CCOC2(CCCCC2)C1.
What is the InChIKey of N-(1-oxaspiro[5.5]undecan-4-yl)-2-(1,2-oxazol-3-yl)acetamide?
The InChIKey is BHQAIDSJFWGVLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3/c18-14(10-12-5-9-20-17-12)16-13-4-8-19-15(11-13)6-2-1-3-7-15/h5,9,13H,1-4,6-8,10-11H2,(H,16,18).
What are the key properties of N-(1-oxaspiro[5.5]undecan-4-yl)-2-(1,2-oxazol-3-yl)acetamide?
N-(1-oxaspiro[5.5]undecan-4-yl)-2-(1,2-oxazol-3-yl)acetamide has a molecular weight of 278.35 g/mol, XLogP of 2.22, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-oxaspiro[5.5]undecan-4-yl)-2-(1,2-oxazol-3-yl)acetamide is sourced from PubChem (CID 71968225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).