N-[5-[2-(4-fluorophenyl)ethylamino]-2-pyridinyl]oxolane-2-carboxamide

C18H20FN3O2 — CID 113028252

IUPACN-[5-[2-(4-fluorophenyl)ethylamino]-2-pyridinyl]oxolane-2-carboxamide
SMILESO=C(Nc1ccc(NCCc2ccc(F)cc2)cn1)C1CCCO1
InChIInChI=1S/C18H20FN3O2/c19-14-5-3-13(4-6-14)9-10-20-15-7-8-17(21-12-15)22-18(23)16-2-1-11-24-16/h3-8,12,16,20H,1-2,9-11H2,(H,21,22,23)
InChIKeyNFWHIKUWULWORJ-UHFFFAOYSA-N
MW329.38 g/mol
LogP2.99
Rot. Bonds6

About N-[5-[2-(4-fluorophenyl)ethylamino]-2-pyridinyl]oxolane-2-carboxamide

N-[5-[2-(4-fluorophenyl)ethylamino]-2-pyridinyl]oxolane-2-carboxamide (PubChem CID 113028252) has the molecular formula C18H20FN3O2 and a molecular weight of 329.38 g/mol. Its IUPAC name is N-[5-[2-(4-fluorophenyl)ethylamino]-2-pyridinyl]oxolane-2-carboxamide.

Molecular Properties

Compound NameN-[5-[2-(4-fluorophenyl)ethylamino]-2-pyridinyl]oxolane-2-carboxamide
PubChem CID113028252
Molecular FormulaC18H20FN3O2
Molecular Weight329.38 g/mol
Exact Mass329.15
IUPAC NameN-[5-[2-(4-fluorophenyl)ethylamino]-2-pyridinyl]oxolane-2-carboxamide
SMILESO=C(Nc1ccc(NCCc2ccc(F)cc2)cn1)C1CCCO1
InChIInChI=1S/C18H20FN3O2/c19-14-5-3-13(4-6-14)9-10-20-15-7-8-17(21-12-15)22-18(23)16-2-1-11-24-16/h3-8,12,16,20H,1-2,9-11H2,(H,21,22,23)
InChIKeyNFWHIKUWULWORJ-UHFFFAOYSA-N
XLogP2.99
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.38
LogP ≤ 52.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[5-[2-(4-fluorophenyl)ethylamino]-2-pyridinyl]cyclobutanecarboxamide
CID 113028301
N-[5-[3-(dimethylamino)propylamino]-2-pyridinyl]oxolane-2-carboxamide
CID 113025707
N-[5-(cycloheptylamino)-2-pyridinyl]oxolane-2-carboxamide
CID 113030095
N-[6-(ethylamino)-3-pyridinyl]oxolane-2-carboxamide
CID 115268574
N-[6-[2-(3-methoxyphenyl)ethylamino]-3-pyridinyl]oxolane-2-carboxamide
CID 113013421
(2R)-N-[2-(4-fluorophenyl)ethyl]oxane-2-carboxamide
CID 96587677
(2S)-N-(5-iodo-2-pyridinyl)oxolane-2-carboxamide
CID 103873257
(2S)-N-(5-bromo-2-pyridinyl)oxolane-2-carboxamide
CID 7346608
(2R)-N-[5-[(4-fluorophenyl)methyl]-1,3-thiazol-2-yl]oxolane-2-carboxamide
CID 675301
N-[6-(2,6-difluoroanilino)-3-pyridinyl]oxolane-2-carboxamide
CID 113023110
N-cycloheptyl-6-[2-(4-fluorophenyl)ethylamino]pyridine-3-carboxamide
CID 109158626
N-[4-[(4-fluorophenyl)methylcarbamoyl]phenyl]oxolane-2-carboxamide
CID 4198331

Frequently Asked Questions

What is the IUPAC name of N-[5-[2-(4-fluorophenyl)ethylamino]-2-pyridinyl]oxolane-2-carboxamide?
The IUPAC name of N-[5-[2-(4-fluorophenyl)ethylamino]-2-pyridinyl]oxolane-2-carboxamide (CID 113028252) is N-[5-[2-(4-fluorophenyl)ethylamino]-2-pyridinyl]oxolane-2-carboxamide.
What is the SMILES notation for N-[5-[2-(4-fluorophenyl)ethylamino]-2-pyridinyl]oxolane-2-carboxamide?
The canonical SMILES for N-[5-[2-(4-fluorophenyl)ethylamino]-2-pyridinyl]oxolane-2-carboxamide is O=C(Nc1ccc(NCCc2ccc(F)cc2)cn1)C1CCCO1.
What is the InChIKey of N-[5-[2-(4-fluorophenyl)ethylamino]-2-pyridinyl]oxolane-2-carboxamide?
The InChIKey is NFWHIKUWULWORJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20FN3O2/c19-14-5-3-13(4-6-14)9-10-20-15-7-8-17(21-12-15)22-18(23)16-2-1-11-24-16/h3-8,12,16,20H,1-2,9-11H2,(H,21,22,23).
What are the key properties of N-[5-[2-(4-fluorophenyl)ethylamino]-2-pyridinyl]oxolane-2-carboxamide?
N-[5-[2-(4-fluorophenyl)ethylamino]-2-pyridinyl]oxolane-2-carboxamide has a molecular weight of 329.38 g/mol, XLogP of 2.99, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[2-(4-fluorophenyl)ethylamino]-2-pyridinyl]oxolane-2-carboxamide is sourced from PubChem (CID 113028252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).