5-(4-fluorophenyl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-6-propan-2-yloxypyridine-3-carboxamide

C19H19FN4O3 — CID 70890699

IUPAC5-(4-fluorophenyl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-6-propan-2-yloxypyridine-3-carboxamide
SMILESCc1noc(CNC(=O)c2cnc(OC(C)C)c(-c3ccc(F)cc3)c2)n1
InChIInChI=1S/C19H19FN4O3/c1-11(2)26-19-16(13-4-6-15(20)7-5-13)8-14(9-22-19)18(25)21-10-17-23-12(3)24-27-17/h4-9,11H,10H2,1-3H3,(H,21,25)
InChIKeyKBOUIHCVSOGXMN-UHFFFAOYSA-N
MW370.38 g/mol
LogP3.30
Rot. Bonds6

About 5-(4-fluorophenyl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-6-propan-2-yloxypyridine-3-carboxamide

5-(4-fluorophenyl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-6-propan-2-yloxypyridine-3-carboxamide (PubChem CID 70890699) has the molecular formula C19H19FN4O3 and a molecular weight of 370.38 g/mol. Its IUPAC name is 5-(4-fluorophenyl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-6-propan-2-yloxypyridine-3-carboxamide.

Molecular Properties

Compound Name5-(4-fluorophenyl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-6-propan-2-yloxypyridine-3-carboxamide
PubChem CID70890699
Molecular FormulaC19H19FN4O3
Molecular Weight370.38 g/mol
Exact Mass370.14
IUPAC Name5-(4-fluorophenyl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-6-propan-2-yloxypyridine-3-carboxamide
SMILESCc1noc(CNC(=O)c2cnc(OC(C)C)c(-c3ccc(F)cc3)c2)n1
InChIInChI=1S/C19H19FN4O3/c1-11(2)26-19-16(13-4-6-15(20)7-5-13)8-14(9-22-19)18(25)21-10-17-23-12(3)24-27-17/h4-9,11H,10H2,1-3H3,(H,21,25)
InChIKeyKBOUIHCVSOGXMN-UHFFFAOYSA-N
XLogP3.30
TPSA90.14 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.38
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-(3,4-difluorophenyl)-6-(2-methoxyethoxy)-N-[[3-(trifluoromethyl)-1,2,4-oxadiazol-5-yl]methyl]pyridine-3-carboxamide
CID 56929560
2-bromo-4-fluoro-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]benzamide
CID 54903528
3-amino-4-fluoro-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]benzamide
CID 61139818
N-(2-cyclopropyl-2-hydroxypropyl)-5-(4-fluorophenyl)-6-[(5-methyl-1,2-oxazol-3-yl)methoxy]pyridine-3-carboxamide
CID 21109677
5-(4-chlorophenyl)-N-[(3-methoxy-1,2-oxazol-5-yl)methyl]-6-(1,1,1-trifluoropropan-2-yloxy)pyridine-3-carboxamide
CID 66687293
5-(4-chlorophenyl)-N-[(3-methoxy-1,2-oxazol-5-yl)methyl]-6-[(2S)-1,1,1-trifluoropropan-2-yl]oxypyridine-3-carboxamide
CID 56928594
5-chloro-6-(ethylamino)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]pyridine-3-carboxamide
CID 62178606
1-(4-fluorophenyl)sulfonyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]pyrrole-3-carboxamide
CID 146501032
6-cyclobutyloxy-5-(3,4-difluorophenyl)-N-[[3-(trifluoromethyl)-1,2,4-oxadiazol-5-yl]methyl]pyridine-3-carboxamide
CID 56929464
3-hydroxy-4-iodo-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]benzamide
CID 104627817
3-iodo-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]benzamide
CID 61400580
5-carbamothioyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]pyridine-2-carboxamide
CID 63749206

Frequently Asked Questions

What is the IUPAC name of 5-(4-fluorophenyl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-6-propan-2-yloxypyridine-3-carboxamide?
The IUPAC name of 5-(4-fluorophenyl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-6-propan-2-yloxypyridine-3-carboxamide (CID 70890699) is 5-(4-fluorophenyl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-6-propan-2-yloxypyridine-3-carboxamide.
What is the SMILES notation for 5-(4-fluorophenyl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-6-propan-2-yloxypyridine-3-carboxamide?
The canonical SMILES for 5-(4-fluorophenyl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-6-propan-2-yloxypyridine-3-carboxamide is Cc1noc(CNC(=O)c2cnc(OC(C)C)c(-c3ccc(F)cc3)c2)n1.
What is the InChIKey of 5-(4-fluorophenyl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-6-propan-2-yloxypyridine-3-carboxamide?
The InChIKey is KBOUIHCVSOGXMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19FN4O3/c1-11(2)26-19-16(13-4-6-15(20)7-5-13)8-14(9-22-19)18(25)21-10-17-23-12(3)24-27-17/h4-9,11H,10H2,1-3H3,(H,21,25).
What are the key properties of 5-(4-fluorophenyl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-6-propan-2-yloxypyridine-3-carboxamide?
5-(4-fluorophenyl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-6-propan-2-yloxypyridine-3-carboxamide has a molecular weight of 370.38 g/mol, XLogP of 3.30, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-fluorophenyl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-6-propan-2-yloxypyridine-3-carboxamide is sourced from PubChem (CID 70890699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).