O-[3-[3-(2-methoxyphenoxy)azetidin-1-yl]cyclohexyl]hydroxylamine

C16H24N2O3 — CID 170319296

IUPACO-[3-[3-(2-methoxyphenoxy)azetidin-1-yl]cyclohexyl]hydroxylamine
SMILESCOc1ccccc1OC1CN(C2CCCC(ON)C2)C1
InChIInChI=1S/C16H24N2O3/c1-19-15-7-2-3-8-16(15)20-14-10-18(11-14)12-5-4-6-13(9-12)21-17/h2-3,7-8,12-14H,4-6,9-11,17H2,1H3
InChIKeyFXIFJTMXNIUPPJ-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.96
Rot. Bonds5

About O-[3-[3-(2-methoxyphenoxy)azetidin-1-yl]cyclohexyl]hydroxylamine

O-[3-[3-(2-methoxyphenoxy)azetidin-1-yl]cyclohexyl]hydroxylamine (PubChem CID 170319296) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is O-[3-[3-(2-methoxyphenoxy)azetidin-1-yl]cyclohexyl]hydroxylamine.

Molecular Properties

Compound NameO-[3-[3-(2-methoxyphenoxy)azetidin-1-yl]cyclohexyl]hydroxylamine
PubChem CID170319296
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC NameO-[3-[3-(2-methoxyphenoxy)azetidin-1-yl]cyclohexyl]hydroxylamine
SMILESCOc1ccccc1OC1CN(C2CCCC(ON)C2)C1
InChIInChI=1S/C16H24N2O3/c1-19-15-7-2-3-8-16(15)20-14-10-18(11-14)12-5-4-6-13(9-12)21-17/h2-3,7-8,12-14H,4-6,9-11,17H2,1H3
InChIKeyFXIFJTMXNIUPPJ-UHFFFAOYSA-N
XLogP1.96
TPSA56.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3-[3-(2-methoxyphenoxy)azetidin-1-yl]cyclohexan-1-ol
CID 163258410
3-(2-fluorophenoxy)-1-(3-methoxycyclohexyl)azetidine
CID 163258466
1-(4-bromocyclohexyl)oxy-2-methoxybenzene
CID 174500132
4-(2-methoxyphenoxy)-1-piperidin-3-ylpiperidine
CID 56713457
1,2-dicyclohexyloxybenzene
CID 67331328
(3S)-3-(2-methoxyphenoxy)oxolane
CID 141103497
benzamide;3-cyclopentyloxy-4-methoxybenzamide
CID 18691056
3-(2-methoxyphenoxy)-N-methylcyclopentan-1-amine
CID 79643718
2-(2-methoxyphenyl)-1,2,3,5,6,7,8,8a-octahydroindolizine
CID 10308007
[3-(2-methoxyphenoxy)azetidin-1-yl]-[(3R)-oxolan-3-yl]methanone
CID 96581278
3-[3-(2-methoxyphenoxy)pyrrolidin-1-yl]propan-1-amine
CID 15624038
(7aS)-1-methyl-6-pyrrolidin-1-yl-2,3,3a,4,5,6,7,7a-octahydroindole;1,2-dimethoxybenzene;ethane
CID 171567539

Frequently Asked Questions

What is the IUPAC name of O-[3-[3-(2-methoxyphenoxy)azetidin-1-yl]cyclohexyl]hydroxylamine?
The IUPAC name of O-[3-[3-(2-methoxyphenoxy)azetidin-1-yl]cyclohexyl]hydroxylamine (CID 170319296) is O-[3-[3-(2-methoxyphenoxy)azetidin-1-yl]cyclohexyl]hydroxylamine.
What is the SMILES notation for O-[3-[3-(2-methoxyphenoxy)azetidin-1-yl]cyclohexyl]hydroxylamine?
The canonical SMILES for O-[3-[3-(2-methoxyphenoxy)azetidin-1-yl]cyclohexyl]hydroxylamine is COc1ccccc1OC1CN(C2CCCC(ON)C2)C1.
What is the InChIKey of O-[3-[3-(2-methoxyphenoxy)azetidin-1-yl]cyclohexyl]hydroxylamine?
The InChIKey is FXIFJTMXNIUPPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-19-15-7-2-3-8-16(15)20-14-10-18(11-14)12-5-4-6-13(9-12)21-17/h2-3,7-8,12-14H,4-6,9-11,17H2,1H3.
What are the key properties of O-[3-[3-(2-methoxyphenoxy)azetidin-1-yl]cyclohexyl]hydroxylamine?
O-[3-[3-(2-methoxyphenoxy)azetidin-1-yl]cyclohexyl]hydroxylamine has a molecular weight of 292.38 g/mol, XLogP of 1.96, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for O-[3-[3-(2-methoxyphenoxy)azetidin-1-yl]cyclohexyl]hydroxylamine is sourced from PubChem (CID 170319296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).