2-(1-hydroxycyclohexyl)-1-(6-oxa-2-azaspiro[3.5]nonan-2-yl)ethanone

C15H25NO3 — CID 136542893

IUPAC2-(1-hydroxycyclohexyl)-1-(6-oxa-2-azaspiro[3.5]nonan-2-yl)ethanone
SMILESO=C(CC1(O)CCCCC1)N1CC2(CCCOC2)C1
InChIInChI=1S/C15H25NO3/c17-13(9-15(18)6-2-1-3-7-15)16-10-14(11-16)5-4-8-19-12-14/h18H,1-12H2
InChIKeyLRXONCBBVIBDDU-UHFFFAOYSA-N
MW267.37 g/mol
LogP1.71
Rot. Bonds2

About 2-(1-hydroxycyclohexyl)-1-(6-oxa-2-azaspiro[3.5]nonan-2-yl)ethanone

2-(1-hydroxycyclohexyl)-1-(6-oxa-2-azaspiro[3.5]nonan-2-yl)ethanone (PubChem CID 136542893) has the molecular formula C15H25NO3 and a molecular weight of 267.37 g/mol. Its IUPAC name is 2-(1-hydroxycyclohexyl)-1-(6-oxa-2-azaspiro[3.5]nonan-2-yl)ethanone.

Molecular Properties

Compound Name2-(1-hydroxycyclohexyl)-1-(6-oxa-2-azaspiro[3.5]nonan-2-yl)ethanone
PubChem CID136542893
Molecular FormulaC15H25NO3
Molecular Weight267.37 g/mol
Exact Mass267.18
IUPAC Name2-(1-hydroxycyclohexyl)-1-(6-oxa-2-azaspiro[3.5]nonan-2-yl)ethanone
SMILESO=C(CC1(O)CCCCC1)N1CC2(CCCOC2)C1
InChIInChI=1S/C15H25NO3/c17-13(9-15(18)6-2-1-3-7-15)16-10-14(11-16)5-4-8-19-12-14/h18H,1-12H2
InChIKeyLRXONCBBVIBDDU-UHFFFAOYSA-N
XLogP1.71
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(1-hydroxycyclohexyl)-1-(6-oxa-2-azaspiro[3.5]nonan-2-yl)ethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-amino-1-(2-oxa-8-azaspiro[5.5]undecan-8-yl)butan-1-one;hydrochloride
CID 119801721
2-(1-hydroxycyclohexyl)-1-[4-(2-morpholin-4-ylethyl)piperidin-1-yl]ethanone
CID 75423557
N-ethyl-N'-[(1-hydroxycyclohexyl)methyl]-2-oxa-8-azaspiro[5.5]undecane-8-carboximidamide
CID 119152451
1-(6-benzyl-2,6-diazaspiro[3.3]heptan-2-yl)-2-(3-hydroxyoxolan-3-yl)ethanone
CID 154869978
2-(4-hydroxyoxepan-4-yl)acetic acid
CID 65081306
2-cyclohexyl-1-[4-[2-(1-hydroxycyclopentyl)acetyl]piperazin-1-yl]ethanone
CID 111537735
1-[4-(2,4-dichlorophenyl)piperazin-1-yl]-2-(3-hydroxyoxan-3-yl)ethanone
CID 166381429
1-[2-[(dimethylamino)methyl]-1,10-dioxa-7-azaspiro[4.6]undecan-7-yl]-2-(1-hydroxycyclobutyl)ethanone;2,2,2-trifluoroacetic acid
CID 155869325
ethyl 3-(3-hydroxyoxan-3-yl)propanoate
CID 66322542
2-(1-hydroxycyclobutyl)-1-piperazin-1-ylethanone
CID 82505839
[(6S)-11-ethyl-8-oxa-2,11-diazaspiro[5.6]dodecan-2-yl]-pyrrolidin-1-ylmethanone
CID 97372902
2-(4-hydroxy-1-methylpiperidin-4-yl)-1-piperidin-1-ylethanone
CID 175786218

Frequently Asked Questions

What is the IUPAC name of 2-(1-hydroxycyclohexyl)-1-(6-oxa-2-azaspiro[3.5]nonan-2-yl)ethanone?
The IUPAC name of 2-(1-hydroxycyclohexyl)-1-(6-oxa-2-azaspiro[3.5]nonan-2-yl)ethanone (CID 136542893) is 2-(1-hydroxycyclohexyl)-1-(6-oxa-2-azaspiro[3.5]nonan-2-yl)ethanone.
What is the SMILES notation for 2-(1-hydroxycyclohexyl)-1-(6-oxa-2-azaspiro[3.5]nonan-2-yl)ethanone?
The canonical SMILES for 2-(1-hydroxycyclohexyl)-1-(6-oxa-2-azaspiro[3.5]nonan-2-yl)ethanone is O=C(CC1(O)CCCCC1)N1CC2(CCCOC2)C1.
What is the InChIKey of 2-(1-hydroxycyclohexyl)-1-(6-oxa-2-azaspiro[3.5]nonan-2-yl)ethanone?
The InChIKey is LRXONCBBVIBDDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO3/c17-13(9-15(18)6-2-1-3-7-15)16-10-14(11-16)5-4-8-19-12-14/h18H,1-12H2.
What are the key properties of 2-(1-hydroxycyclohexyl)-1-(6-oxa-2-azaspiro[3.5]nonan-2-yl)ethanone?
2-(1-hydroxycyclohexyl)-1-(6-oxa-2-azaspiro[3.5]nonan-2-yl)ethanone has a molecular weight of 267.37 g/mol, XLogP of 1.71, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-hydroxycyclohexyl)-1-(6-oxa-2-azaspiro[3.5]nonan-2-yl)ethanone is sourced from PubChem (CID 136542893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).