N-[(1R)-1-cyclobutylethyl]-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide

C19H21FN2O2 — CID 58368103

IUPACN-[(1R)-1-cyclobutylethyl]-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide
SMILESC[C@@H](NC(=O)c1ccc(OCc2cccc(F)c2)nc1)C1CCC1
InChIInChI=1S/C19H21FN2O2/c1-13(15-5-3-6-15)22-19(23)16-8-9-18(21-11-16)24-12-14-4-2-7-17(20)10-14/h2,4,7-11,13,15H,3,5-6,12H2,1H3,(H,22,23)/t13-/m1/s1
InChIKeyXRMSUEYSIUUAIL-CYBMUJFWSA-N
MW328.39 g/mol
LogP3.72
Rot. Bonds6

About N-[(1R)-1-cyclobutylethyl]-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide

N-[(1R)-1-cyclobutylethyl]-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide (PubChem CID 58368103) has the molecular formula C19H21FN2O2 and a molecular weight of 328.39 g/mol. Its IUPAC name is N-[(1R)-1-cyclobutylethyl]-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(1R)-1-cyclobutylethyl]-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide
PubChem CID58368103
Molecular FormulaC19H21FN2O2
Molecular Weight328.39 g/mol
Exact Mass328.16
IUPAC NameN-[(1R)-1-cyclobutylethyl]-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide
SMILESC[C@@H](NC(=O)c1ccc(OCc2cccc(F)c2)nc1)C1CCC1
InChIInChI=1S/C19H21FN2O2/c1-13(15-5-3-6-15)22-19(23)16-8-9-18(21-11-16)24-12-14-4-2-7-17(20)10-14/h2,4,7-11,13,15H,3,5-6,12H2,1H3,(H,22,23)/t13-/m1/s1
InChIKeyXRMSUEYSIUUAIL-CYBMUJFWSA-N
XLogP3.72
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.39
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-cyclopropylethyl)-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide
CID 76736087
6-[(3-fluorophenyl)methoxy]-N-[1-(oxan-2-yl)ethyl]pyridine-3-carboxamide
CID 58368122
N-[(1R)-1-(2,2-dimethyloxan-4-yl)ethyl]-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide
CID 58368082
N-[(1R)-1-cyclohexylethyl]-6-[(3-fluorophenyl)methoxy]-5-methylpyridine-3-carboxamide
CID 58368095
6-[(3-fluorophenyl)methoxy]-N-[(2S)-3-hydroxy-3-methylbutan-2-yl]pyridine-3-carboxamide
CID 58368200
6-[(3-fluorophenyl)methoxy]-N-[1-(iodoamino)-1-oxopropan-2-yl]pyridine-3-carboxamide
CID 87552135
N-(3-fluorophenyl)-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide
CID 58368181
N-(1-cyclohexylethyl)-6-[(3-fluorophenoxy)methyl]pyridine-3-carboxamide
CID 58533707
N-cyclobutyl-6-[(3-methylphenyl)methoxy]pyridine-3-carboxamide
CID 58368099
N-[(1S)-2,2-dimethylcyclopentyl]-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide
CID 58368249
N-(1-cyclobutylethyl)-6-fluoropyridine-3-carboxamide
CID 115769021
N-(2-amino-2-oxoethyl)-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide
CID 10286337

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-cyclobutylethyl]-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide?
The IUPAC name of N-[(1R)-1-cyclobutylethyl]-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide (CID 58368103) is N-[(1R)-1-cyclobutylethyl]-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide.
What is the SMILES notation for N-[(1R)-1-cyclobutylethyl]-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide?
The canonical SMILES for N-[(1R)-1-cyclobutylethyl]-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide is C[C@@H](NC(=O)c1ccc(OCc2cccc(F)c2)nc1)C1CCC1.
What is the InChIKey of N-[(1R)-1-cyclobutylethyl]-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide?
The InChIKey is XRMSUEYSIUUAIL-CYBMUJFWSA-N. The full InChI is InChI=1S/C19H21FN2O2/c1-13(15-5-3-6-15)22-19(23)16-8-9-18(21-11-16)24-12-14-4-2-7-17(20)10-14/h2,4,7-11,13,15H,3,5-6,12H2,1H3,(H,22,23)/t13-/m1/s1.
What are the key properties of N-[(1R)-1-cyclobutylethyl]-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide?
N-[(1R)-1-cyclobutylethyl]-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide has a molecular weight of 328.39 g/mol, XLogP of 3.72, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-cyclobutylethyl]-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide is sourced from PubChem (CID 58368103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).