2-cyclohexyloxy-N-[(2S,3S)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]acetamide

C17H27N3O3 — CID 128986230

IUPAC2-cyclohexyloxy-N-[(2S,3S)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]acetamide
SMILESCCn1ccnc1[C@H]1OCC[C@@H]1NC(=O)COC1CCCCC1
InChIInChI=1S/C17H27N3O3/c1-2-20-10-9-18-17(20)16-14(8-11-22-16)19-15(21)12-23-13-6-4-3-5-7-13/h9-10,13-14,16H,2-8,11-12H2,1H3,(H,19,21)/t14-,16-/m0/s1
InChIKeyGPRSTLSXOFDUOJ-HOCLYGCPSA-N
MW321.42 g/mol
LogP2.20
Rot. Bonds6

About 2-cyclohexyloxy-N-[(2S,3S)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]acetamide

2-cyclohexyloxy-N-[(2S,3S)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]acetamide (PubChem CID 128986230) has the molecular formula C17H27N3O3 and a molecular weight of 321.42 g/mol. Its IUPAC name is 2-cyclohexyloxy-N-[(2S,3S)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]acetamide.

Molecular Properties

Compound Name2-cyclohexyloxy-N-[(2S,3S)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]acetamide
PubChem CID128986230
Molecular FormulaC17H27N3O3
Molecular Weight321.42 g/mol
Exact Mass321.21
IUPAC Name2-cyclohexyloxy-N-[(2S,3S)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]acetamide
SMILESCCn1ccnc1[C@H]1OCC[C@@H]1NC(=O)COC1CCCCC1
InChIInChI=1S/C17H27N3O3/c1-2-20-10-9-18-17(20)16-14(8-11-22-16)19-15(21)12-23-13-6-4-3-5-7-13/h9-10,13-14,16H,2-8,11-12H2,1H3,(H,19,21)/t14-,16-/m0/s1
InChIKeyGPRSTLSXOFDUOJ-HOCLYGCPSA-N
XLogP2.20
TPSA65.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.42
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-2-(cyclopropylmethoxy)-N-[(2S,3S)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]propanamide
CID 129335309
N-[(2S,3S)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]-5-methyl-1,2,4-oxadiazole-3-carboxamide
CID 128977398
5-ethyl-N-[(2S,3S)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]furan-2-carboxamide
CID 128986202
N-[(2S,3S)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]-6-methylpyridine-2-carboxamide
CID 128986179
N-[(2S,3S)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]-5-propan-2-yl-1H-pyrazole-3-carboxamide
CID 128986192
1-[(2S,3S)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]-3-(1-methylpyrazol-3-yl)urea
CID 128982943
[5-[[[(2S,3S)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]amino]methyl]furan-2-yl]methanol
CID 128970916
N-[(2S,3S)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]-3,5-difluoropyridine-2-carboxamide
CID 128989734
N-[(2S,3S)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]imidazo[1,2-a]pyridine-7-carboxamide
CID 128986150
cis-(1S,3R)-3-[[(2S,3S)-2-(1-ethylimidazol-2-yl)oxan-3-yl]carbamoyl]-2,2-dimethylcyclopropane-1-carboxylic acid
CID 122066905
N-[(2S,3S)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]-3-methylimidazo[4,5-b]pyridine-6-carboxamide
CID 167954245
N-[(2S,3S)-2-(1-ethylimidazol-2-yl)oxan-3-yl]-2,3-dihydro-1-benzofuran-2-carboxamide
CID 136581065

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyloxy-N-[(2S,3S)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]acetamide?
The IUPAC name of 2-cyclohexyloxy-N-[(2S,3S)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]acetamide (CID 128986230) is 2-cyclohexyloxy-N-[(2S,3S)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]acetamide.
What is the SMILES notation for 2-cyclohexyloxy-N-[(2S,3S)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]acetamide?
The canonical SMILES for 2-cyclohexyloxy-N-[(2S,3S)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]acetamide is CCn1ccnc1[C@H]1OCC[C@@H]1NC(=O)COC1CCCCC1.
What is the InChIKey of 2-cyclohexyloxy-N-[(2S,3S)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]acetamide?
The InChIKey is GPRSTLSXOFDUOJ-HOCLYGCPSA-N. The full InChI is InChI=1S/C17H27N3O3/c1-2-20-10-9-18-17(20)16-14(8-11-22-16)19-15(21)12-23-13-6-4-3-5-7-13/h9-10,13-14,16H,2-8,11-12H2,1H3,(H,19,21)/t14-,16-/m0/s1.
What are the key properties of 2-cyclohexyloxy-N-[(2S,3S)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]acetamide?
2-cyclohexyloxy-N-[(2S,3S)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]acetamide has a molecular weight of 321.42 g/mol, XLogP of 2.20, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyloxy-N-[(2S,3S)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]acetamide is sourced from PubChem (CID 128986230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).