2-[(3-propan-2-yloxy-2-pyridinyl)oxy]cyclohexan-1-amine

C14H22N2O2 — CID 113395516

IUPAC2-[(3-propan-2-yloxy-2-pyridinyl)oxy]cyclohexan-1-amine
SMILESCC(C)Oc1cccnc1OC1CCCCC1N
InChIInChI=1S/C14H22N2O2/c1-10(2)17-13-8-5-9-16-14(13)18-12-7-4-3-6-11(12)15/h5,8-12H,3-4,6-7,15H2,1-2H3
InChIKeyFEMRGYICQXUIKT-UHFFFAOYSA-N
MW250.34 g/mol
LogP2.52
Rot. Bonds4

About 2-[(3-propan-2-yloxy-2-pyridinyl)oxy]cyclohexan-1-amine

2-[(3-propan-2-yloxy-2-pyridinyl)oxy]cyclohexan-1-amine (PubChem CID 113395516) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 2-[(3-propan-2-yloxy-2-pyridinyl)oxy]cyclohexan-1-amine.

Molecular Properties

Compound Name2-[(3-propan-2-yloxy-2-pyridinyl)oxy]cyclohexan-1-amine
PubChem CID113395516
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name2-[(3-propan-2-yloxy-2-pyridinyl)oxy]cyclohexan-1-amine
SMILESCC(C)Oc1cccnc1OC1CCCCC1N
InChIInChI=1S/C14H22N2O2/c1-10(2)17-13-8-5-9-16-14(13)18-12-7-4-3-6-11(12)15/h5,8-12H,3-4,6-7,15H2,1-2H3
InChIKeyFEMRGYICQXUIKT-UHFFFAOYSA-N
XLogP2.52
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-(2-ethylcyclohexyl)oxy-3-pyridinyl]ethanamine
CID 114056592
2-(1-methylimidazo[4,5-c]pyridin-4-yl)oxycycloheptan-1-amine
CID 103386316
N-[(3-aminocyclohexyl)methyl]-3-propan-2-yloxypyridin-2-amine
CID 106128059
N-(2-methylcyclopentyl)-3-propan-2-yloxypyridin-2-amine
CID 112568510
2-(5-bromoisoquinolin-1-yl)oxycyclopentan-1-amine
CID 106542189
2-(2-ethoxyphenoxy)cyclopentan-1-amine
CID 16781253
3-propan-2-yloxy-2-(2,2,2-trifluoroethoxy)pyridine
CID 164741273
3-(2-aminocycloheptyl)oxy-1H-pyrazin-2-one
CID 114571252
N-[2-(chloromethyl)cyclopentyl]-3-propan-2-yloxypyridin-2-amine
CID 106365544
2-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)oxycyclopentan-1-amine
CID 104733586
2-[(3,5-dichloro-2-pyridinyl)oxy]cycloheptan-1-amine
CID 113395361
(1S)-1-(2-cyclopentyloxy-3-pyridinyl)ethanamine
CID 103695133

Frequently Asked Questions

What is the IUPAC name of 2-[(3-propan-2-yloxy-2-pyridinyl)oxy]cyclohexan-1-amine?
The IUPAC name of 2-[(3-propan-2-yloxy-2-pyridinyl)oxy]cyclohexan-1-amine (CID 113395516) is 2-[(3-propan-2-yloxy-2-pyridinyl)oxy]cyclohexan-1-amine.
What is the SMILES notation for 2-[(3-propan-2-yloxy-2-pyridinyl)oxy]cyclohexan-1-amine?
The canonical SMILES for 2-[(3-propan-2-yloxy-2-pyridinyl)oxy]cyclohexan-1-amine is CC(C)Oc1cccnc1OC1CCCCC1N.
What is the InChIKey of 2-[(3-propan-2-yloxy-2-pyridinyl)oxy]cyclohexan-1-amine?
The InChIKey is FEMRGYICQXUIKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-10(2)17-13-8-5-9-16-14(13)18-12-7-4-3-6-11(12)15/h5,8-12H,3-4,6-7,15H2,1-2H3.
What are the key properties of 2-[(3-propan-2-yloxy-2-pyridinyl)oxy]cyclohexan-1-amine?
2-[(3-propan-2-yloxy-2-pyridinyl)oxy]cyclohexan-1-amine has a molecular weight of 250.34 g/mol, XLogP of 2.52, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-propan-2-yloxy-2-pyridinyl)oxy]cyclohexan-1-amine is sourced from PubChem (CID 113395516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).