2-[5-[(5-fluoro-2-pyridinyl)oxy]-2-pyridinyl]-6-azaspiro[2.5]octane-2-carboxamide;hydrochloride

C18H20ClFN4O2 — CID 175770289

IUPAC2-[5-[(5-fluoro-2-pyridinyl)oxy]-2-pyridinyl]-6-azaspiro[2.5]octane-2-carboxamide;hydrochloride
SMILESCl.NC(=O)C1(c2ccc(Oc3ccc(F)cn3)cn2)CC12CCNCC2
InChIInChI=1S/C18H19FN4O2.ClH/c19-12-1-4-15(23-9-12)25-13-2-3-14(22-10-13)18(16(20)24)11-17(18)5-7-21-8-6-17;/h1-4,9-10,21H,5-8,11H2,(H2,20,24);1H
InChIKeyGVJACPUBXSBFKE-UHFFFAOYSA-N
MW378.84 g/mol
LogP2.33
Rot. Bonds4

About 2-[5-[(5-fluoro-2-pyridinyl)oxy]-2-pyridinyl]-6-azaspiro[2.5]octane-2-carboxamide;hydrochloride

2-[5-[(5-fluoro-2-pyridinyl)oxy]-2-pyridinyl]-6-azaspiro[2.5]octane-2-carboxamide;hydrochloride (PubChem CID 175770289) has the molecular formula C18H20ClFN4O2 and a molecular weight of 378.84 g/mol. Its IUPAC name is 2-[5-[(5-fluoro-2-pyridinyl)oxy]-2-pyridinyl]-6-azaspiro[2.5]octane-2-carboxamide;hydrochloride.

Molecular Properties

Compound Name2-[5-[(5-fluoro-2-pyridinyl)oxy]-2-pyridinyl]-6-azaspiro[2.5]octane-2-carboxamide;hydrochloride
PubChem CID175770289
Molecular FormulaC18H20ClFN4O2
Molecular Weight378.84 g/mol
Exact Mass378.13
IUPAC Name2-[5-[(5-fluoro-2-pyridinyl)oxy]-2-pyridinyl]-6-azaspiro[2.5]octane-2-carboxamide;hydrochloride
SMILESCl.NC(=O)C1(c2ccc(Oc3ccc(F)cn3)cn2)CC12CCNCC2
InChIInChI=1S/C18H19FN4O2.ClH/c19-12-1-4-15(23-9-12)25-13-2-3-14(22-10-13)18(16(20)24)11-17(18)5-7-21-8-6-17;/h1-4,9-10,21H,5-8,11H2,(H2,20,24);1H
InChIKeyGVJACPUBXSBFKE-UHFFFAOYSA-N
XLogP2.33
TPSA90.13 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.84
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-[5-[(5-fluoro-2-pyridinyl)oxy]-2-pyridinyl]-6-azaspiro[2.5]octane-2-carboxamide;hydrochloride with MolForge

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Related Compounds

2-[5-[(5-fluoro-2-pyridinyl)oxy]-2-pyridinyl]propanamide
CID 164734546
1-amino-N-[6-(4-fluorophenoxy)-3-pyridinyl]cyclopentane-1-carboxamide;dihydrochloride
CID 119849089
1-amino-N-[6-(4-fluorophenoxy)-3-pyridinyl]cyclopentane-1-carboxamide
CID 119849090
1-amino-N-[[6-(4-fluorophenoxy)-3-pyridinyl]methyl]cyclohexane-1-carboxamide;dihydrochloride
CID 119847805
1,4-diazepan-1-yl-[6-(4-fluorophenoxy)-3-pyridinyl]methanone
CID 24770965
2-fluoro-4-[(5-fluoro-2-pyridinyl)oxy]benzoic acid
CID 107677466
(E)-3-[6-(4-fluorophenoxy)-3-pyridinyl]prop-2-enoic acid
CID 21287966
ethyl 6-(4-fluorophenoxy)pyridine-3-carboxylate
CID 23149051
4-(aminomethyl)-N-[6-(4-fluorophenoxy)-3-pyridinyl]oxane-4-carboxamide
CID 120939094
2-[5-[(5-fluoro-2-pyridinyl)oxy]-2-pyridinyl]-2-[(3R)-3-(6-oxo-1H-pyridin-3-yl)cyclohexyl]propanamide
CID 175704322
N-[(1R,5S)-3-azabicyclo[3.2.0]heptan-1-yl]-6-(4-fluorophenoxy)pyridine-3-carboxamide
CID 166270764
1-(4-fluorophenyl)-4-(5-fluoro-2-pyridinyl)-4-pyridin-2-yloxycyclohexane-1-carboxamide
CID 59442605

Frequently Asked Questions

What is the IUPAC name of 2-[5-[(5-fluoro-2-pyridinyl)oxy]-2-pyridinyl]-6-azaspiro[2.5]octane-2-carboxamide;hydrochloride?
The IUPAC name of 2-[5-[(5-fluoro-2-pyridinyl)oxy]-2-pyridinyl]-6-azaspiro[2.5]octane-2-carboxamide;hydrochloride (CID 175770289) is 2-[5-[(5-fluoro-2-pyridinyl)oxy]-2-pyridinyl]-6-azaspiro[2.5]octane-2-carboxamide;hydrochloride.
What is the SMILES notation for 2-[5-[(5-fluoro-2-pyridinyl)oxy]-2-pyridinyl]-6-azaspiro[2.5]octane-2-carboxamide;hydrochloride?
The canonical SMILES for 2-[5-[(5-fluoro-2-pyridinyl)oxy]-2-pyridinyl]-6-azaspiro[2.5]octane-2-carboxamide;hydrochloride is Cl.NC(=O)C1(c2ccc(Oc3ccc(F)cn3)cn2)CC12CCNCC2.
What is the InChIKey of 2-[5-[(5-fluoro-2-pyridinyl)oxy]-2-pyridinyl]-6-azaspiro[2.5]octane-2-carboxamide;hydrochloride?
The InChIKey is GVJACPUBXSBFKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FN4O2.ClH/c19-12-1-4-15(23-9-12)25-13-2-3-14(22-10-13)18(16(20)24)11-17(18)5-7-21-8-6-17;/h1-4,9-10,21H,5-8,11H2,(H2,20,24);1H.
What are the key properties of 2-[5-[(5-fluoro-2-pyridinyl)oxy]-2-pyridinyl]-6-azaspiro[2.5]octane-2-carboxamide;hydrochloride?
2-[5-[(5-fluoro-2-pyridinyl)oxy]-2-pyridinyl]-6-azaspiro[2.5]octane-2-carboxamide;hydrochloride has a molecular weight of 378.84 g/mol, XLogP of 2.33, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-[(5-fluoro-2-pyridinyl)oxy]-2-pyridinyl]-6-azaspiro[2.5]octane-2-carboxamide;hydrochloride is sourced from PubChem (CID 175770289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).