N-[1-(4-fluorophenyl)propyl]-1-methyl-2-oxo-6-propan-2-ylpyridine-3-carboxamide

C19H23FN2O2 — CID 74248512

IUPACN-[1-(4-fluorophenyl)propyl]-1-methyl-2-oxo-6-propan-2-ylpyridine-3-carboxamide
SMILESCCC(NC(=O)c1ccc(C(C)C)n(C)c1=O)c1ccc(F)cc1
InChIInChI=1S/C19H23FN2O2/c1-5-16(13-6-8-14(20)9-7-13)21-18(23)15-10-11-17(12(2)3)22(4)19(15)24/h6-12,16H,5H2,1-4H3,(H,21,23)
InChIKeyWICJPQHENNVYTM-UHFFFAOYSA-N
MW330.40 g/mol
LogP3.53
Rot. Bonds5

About N-[1-(4-fluorophenyl)propyl]-1-methyl-2-oxo-6-propan-2-ylpyridine-3-carboxamide

N-[1-(4-fluorophenyl)propyl]-1-methyl-2-oxo-6-propan-2-ylpyridine-3-carboxamide (PubChem CID 74248512) has the molecular formula C19H23FN2O2 and a molecular weight of 330.40 g/mol. Its IUPAC name is N-[1-(4-fluorophenyl)propyl]-1-methyl-2-oxo-6-propan-2-ylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-[1-(4-fluorophenyl)propyl]-1-methyl-2-oxo-6-propan-2-ylpyridine-3-carboxamide
PubChem CID74248512
Molecular FormulaC19H23FN2O2
Molecular Weight330.40 g/mol
Exact Mass330.17
IUPAC NameN-[1-(4-fluorophenyl)propyl]-1-methyl-2-oxo-6-propan-2-ylpyridine-3-carboxamide
SMILESCCC(NC(=O)c1ccc(C(C)C)n(C)c1=O)c1ccc(F)cc1
InChIInChI=1S/C19H23FN2O2/c1-5-16(13-6-8-14(20)9-7-13)21-18(23)15-10-11-17(12(2)3)22(4)19(15)24/h6-12,16H,5H2,1-4H3,(H,21,23)
InChIKeyWICJPQHENNVYTM-UHFFFAOYSA-N
XLogP3.53
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.40
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-fluoro-N-[(1S)-1-phenylpropyl]benzamide
CID 781115
2-bromo-N-[1-(4-bromophenyl)propyl]-4-fluorobenzamide
CID 60666299
1-methyl-N-[4-(methylamino)butyl]-2-oxo-6-propan-2-ylpyridine-3-carboxamide
CID 74250998
2-chloro-N-[(1S)-1-(4-fluorophenyl)propyl]-4-(1,2,4-triazol-4-yl)benzamide
CID 51495989
N-(1-phenylpropyl)-2-propan-2-yloxybenzamide
CID 43911562
6-(4-chlorophenyl)-N-[(1S)-1-(4-fluorophenyl)propyl]-2-(1-methylpyrazol-4-yl)-3-oxopyridazine-4-carboxamide
CID 164896836
7-N-[1-(4-fluorophenyl)ethyl]-5-N-[(1R)-1-phenylpropyl]-2,3-dihydropyrrolo[2,1-b][1,3]thiazole-5,7-dicarboxamide
CID 126514503
2-[1-(4-fluorophenyl)propylamino]-N-propan-2-ylacetamide
CID 43567792
N-(1-phenylpropyl)-4-propan-2-ylbenzamide
CID 17327920
2-amino-N-[1-(4-chlorophenyl)propyl]-3-fluorobenzamide
CID 81499811
N-[1-(4-methylphenyl)propyl]-2-propan-2-yloxybenzamide
CID 132650459
3-bromo-N-[1-(4-chlorophenyl)propyl]-2-fluorobenzamide
CID 107951914

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-fluorophenyl)propyl]-1-methyl-2-oxo-6-propan-2-ylpyridine-3-carboxamide?
The IUPAC name of N-[1-(4-fluorophenyl)propyl]-1-methyl-2-oxo-6-propan-2-ylpyridine-3-carboxamide (CID 74248512) is N-[1-(4-fluorophenyl)propyl]-1-methyl-2-oxo-6-propan-2-ylpyridine-3-carboxamide.
What is the SMILES notation for N-[1-(4-fluorophenyl)propyl]-1-methyl-2-oxo-6-propan-2-ylpyridine-3-carboxamide?
The canonical SMILES for N-[1-(4-fluorophenyl)propyl]-1-methyl-2-oxo-6-propan-2-ylpyridine-3-carboxamide is CCC(NC(=O)c1ccc(C(C)C)n(C)c1=O)c1ccc(F)cc1.
What is the InChIKey of N-[1-(4-fluorophenyl)propyl]-1-methyl-2-oxo-6-propan-2-ylpyridine-3-carboxamide?
The InChIKey is WICJPQHENNVYTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23FN2O2/c1-5-16(13-6-8-14(20)9-7-13)21-18(23)15-10-11-17(12(2)3)22(4)19(15)24/h6-12,16H,5H2,1-4H3,(H,21,23).
What are the key properties of N-[1-(4-fluorophenyl)propyl]-1-methyl-2-oxo-6-propan-2-ylpyridine-3-carboxamide?
N-[1-(4-fluorophenyl)propyl]-1-methyl-2-oxo-6-propan-2-ylpyridine-3-carboxamide has a molecular weight of 330.40 g/mol, XLogP of 3.53, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-fluorophenyl)propyl]-1-methyl-2-oxo-6-propan-2-ylpyridine-3-carboxamide is sourced from PubChem (CID 74248512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).