N-[1-[4-(cyclopropylmethoxy)-3-fluorophenyl]ethyl]-1-methyl-2-oxopyridine-4-carboxamide

C19H21FN2O3 — CID 71919678

IUPACN-[1-[4-(cyclopropylmethoxy)-3-fluorophenyl]ethyl]-1-methyl-2-oxopyridine-4-carboxamide
SMILESCC(NC(=O)c1ccn(C)c(=O)c1)c1ccc(OCC2CC2)c(F)c1
InChIInChI=1S/C19H21FN2O3/c1-12(21-19(24)15-7-8-22(2)18(23)10-15)14-5-6-17(16(20)9-14)25-11-13-3-4-13/h5-10,12-13H,3-4,11H2,1-2H3,(H,21,24)
InChIKeyHKSFBNGLYNLVRF-UHFFFAOYSA-N
MW344.39 g/mol
LogP2.80
Rot. Bonds6

About N-[1-[4-(cyclopropylmethoxy)-3-fluorophenyl]ethyl]-1-methyl-2-oxopyridine-4-carboxamide

N-[1-[4-(cyclopropylmethoxy)-3-fluorophenyl]ethyl]-1-methyl-2-oxopyridine-4-carboxamide (PubChem CID 71919678) has the molecular formula C19H21FN2O3 and a molecular weight of 344.39 g/mol. Its IUPAC name is N-[1-[4-(cyclopropylmethoxy)-3-fluorophenyl]ethyl]-1-methyl-2-oxopyridine-4-carboxamide.

Molecular Properties

Compound NameN-[1-[4-(cyclopropylmethoxy)-3-fluorophenyl]ethyl]-1-methyl-2-oxopyridine-4-carboxamide
PubChem CID71919678
Molecular FormulaC19H21FN2O3
Molecular Weight344.39 g/mol
Exact Mass344.15
IUPAC NameN-[1-[4-(cyclopropylmethoxy)-3-fluorophenyl]ethyl]-1-methyl-2-oxopyridine-4-carboxamide
SMILESCC(NC(=O)c1ccn(C)c(=O)c1)c1ccc(OCC2CC2)c(F)c1
InChIInChI=1S/C19H21FN2O3/c1-12(21-19(24)15-7-8-22(2)18(23)10-15)14-5-6-17(16(20)9-14)25-11-13-3-4-13/h5-10,12-13H,3-4,11H2,1-2H3,(H,21,24)
InChIKeyHKSFBNGLYNLVRF-UHFFFAOYSA-N
XLogP2.80
TPSA60.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.39
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-[4-(cyclopropylmethoxy)-3-fluorophenyl]ethyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide
CID 71852475
2-(2-amino-2-oxoethoxy)-N-[1-[4-(cyclopropylmethoxy)-3-fluorophenyl]ethyl]benzamide
CID 119163719
(2S,4S)-N-[1-[4-(cyclopropylmethoxy)-3-fluorophenyl]ethyl]-2-methylpiperidine-4-carboxamide;hydrochloride
CID 120638097
N-[(1S)-1-(3-ethoxyphenyl)ethyl]-1-methyl-2-oxopyridine-4-carboxamide
CID 97315276
N-[(1R)-1-[4-(cyclopropylmethoxy)-3-fluorophenyl]ethyl]-2-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide
CID 97065846
N-[1-[4-(cyclopropylmethoxy)-3-fluorophenyl]ethyl]-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120638103
N-[(1R)-1-(4-ethoxy-3-fluorophenyl)ethyl]imidazo[1,2-a]pyridine-6-carboxamide
CID 97132156
2-[4-(cyclopropylmethoxy)-3-fluorophenyl]propan-1-amine
CID 117320100
(1S)-1-[4-(cyclopentylmethoxy)-3-fluorophenyl]ethanamine
CID 79034595
N-[(1R)-1-(3-fluoro-4-methoxyphenyl)ethyl]-1,2-dimethylpyrrole-3-carboxamide
CID 124628027
N-[1-[4-(cyclopropylmethoxy)-3-fluorophenyl]ethyl]-9-methylpurin-6-amine
CID 138043646
N-[1-(3-fluoro-4-methoxyphenyl)ethyl]-3,4,5-trimethoxybenzamide
CID 46655748

Frequently Asked Questions

What is the IUPAC name of N-[1-[4-(cyclopropylmethoxy)-3-fluorophenyl]ethyl]-1-methyl-2-oxopyridine-4-carboxamide?
The IUPAC name of N-[1-[4-(cyclopropylmethoxy)-3-fluorophenyl]ethyl]-1-methyl-2-oxopyridine-4-carboxamide (CID 71919678) is N-[1-[4-(cyclopropylmethoxy)-3-fluorophenyl]ethyl]-1-methyl-2-oxopyridine-4-carboxamide.
What is the SMILES notation for N-[1-[4-(cyclopropylmethoxy)-3-fluorophenyl]ethyl]-1-methyl-2-oxopyridine-4-carboxamide?
The canonical SMILES for N-[1-[4-(cyclopropylmethoxy)-3-fluorophenyl]ethyl]-1-methyl-2-oxopyridine-4-carboxamide is CC(NC(=O)c1ccn(C)c(=O)c1)c1ccc(OCC2CC2)c(F)c1.
What is the InChIKey of N-[1-[4-(cyclopropylmethoxy)-3-fluorophenyl]ethyl]-1-methyl-2-oxopyridine-4-carboxamide?
The InChIKey is HKSFBNGLYNLVRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21FN2O3/c1-12(21-19(24)15-7-8-22(2)18(23)10-15)14-5-6-17(16(20)9-14)25-11-13-3-4-13/h5-10,12-13H,3-4,11H2,1-2H3,(H,21,24).
What are the key properties of N-[1-[4-(cyclopropylmethoxy)-3-fluorophenyl]ethyl]-1-methyl-2-oxopyridine-4-carboxamide?
N-[1-[4-(cyclopropylmethoxy)-3-fluorophenyl]ethyl]-1-methyl-2-oxopyridine-4-carboxamide has a molecular weight of 344.39 g/mol, XLogP of 2.80, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[4-(cyclopropylmethoxy)-3-fluorophenyl]ethyl]-1-methyl-2-oxopyridine-4-carboxamide is sourced from PubChem (CID 71919678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).