N-ethyl-3-(3-fluoro-2-methylphenoxy)-N-(6-methoxy-3-pyridinyl)azetidine-1-carboxamide

C19H22FN3O3 — CID 46844643

IUPACN-ethyl-3-(3-fluoro-2-methylphenoxy)-N-(6-methoxy-3-pyridinyl)azetidine-1-carboxamide
SMILESCCN(C(=O)N1CC(Oc2cccc(F)c2C)C1)c1ccc(OC)nc1
InChIInChI=1S/C19H22FN3O3/c1-4-23(14-8-9-18(25-3)21-10-14)19(24)22-11-15(12-22)26-17-7-5-6-16(20)13(17)2/h5-10,15H,4,11-12H2,1-3H3
InChIKeyOXVKAENYXSMWHO-UHFFFAOYSA-N
MW359.40 g/mol
LogP3.25
Rot. Bonds5

About N-ethyl-3-(3-fluoro-2-methylphenoxy)-N-(6-methoxy-3-pyridinyl)azetidine-1-carboxamide

N-ethyl-3-(3-fluoro-2-methylphenoxy)-N-(6-methoxy-3-pyridinyl)azetidine-1-carboxamide (PubChem CID 46844643) has the molecular formula C19H22FN3O3 and a molecular weight of 359.40 g/mol. Its IUPAC name is N-ethyl-3-(3-fluoro-2-methylphenoxy)-N-(6-methoxy-3-pyridinyl)azetidine-1-carboxamide.

Molecular Properties

Compound NameN-ethyl-3-(3-fluoro-2-methylphenoxy)-N-(6-methoxy-3-pyridinyl)azetidine-1-carboxamide
PubChem CID46844643
Molecular FormulaC19H22FN3O3
Molecular Weight359.40 g/mol
Exact Mass359.16
IUPAC NameN-ethyl-3-(3-fluoro-2-methylphenoxy)-N-(6-methoxy-3-pyridinyl)azetidine-1-carboxamide
SMILESCCN(C(=O)N1CC(Oc2cccc(F)c2C)C1)c1ccc(OC)nc1
InChIInChI=1S/C19H22FN3O3/c1-4-23(14-8-9-18(25-3)21-10-14)19(24)22-11-15(12-22)26-17-7-5-6-16(20)13(17)2/h5-10,15H,4,11-12H2,1-3H3
InChIKeyOXVKAENYXSMWHO-UHFFFAOYSA-N
XLogP3.25
TPSA54.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.40
LogP ≤ 53.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-ethoxy-1-[3-(2-fluorophenoxy)azetidin-1-yl]propan-1-one
CID 126438416
[3-(3-fluoro-2-methylphenoxy)cyclobutyl]carbamic acid
CID 67813271
N-ethyl-N-(6-methoxy-3-pyridinyl)-3,4-dihydro-2H-pyran-6-carboxamide
CID 95905024
2-(2-fluorophenyl)-1-[3-(6-methoxypyridazin-3-yl)oxypyrrolidin-1-yl]ethanone
CID 91627502
2-(2-fluorophenoxy)-1-[3-(6-methoxypyrazin-2-yl)oxypyrrolidin-1-yl]ethanone
CID 90637391
3-(4-acetyl-3,5-dimethylpyrazol-1-yl)-1-[3-(2-fluorophenoxy)azetidin-1-yl]butan-1-one
CID 90651927
N,N-diethyl-3-[[6-(trifluoromethyl)-2-pyridinyl]oxy]azetidine-1-carboxamide
CID 122252087
3-(3-fluoro-2-methylphenoxy)cyclobutan-1-amine
CID 67812957
(4R)-4-[3-(2-fluorophenoxy)azetidine-1-carbonyl]-1-(pyridin-2-ylmethyl)pyrrolidin-2-one
CID 97274959
(3-fluoro-4-methoxyphenyl)-[(3R)-3-[(5-methyl-2-pyridinyl)oxy]pyrrolidin-1-yl]methanone
CID 129416784
[2-(3-aminopropoxy)-5-methoxyphenyl]-[3-(2-fluorophenoxy)azetidin-1-yl]methanone
CID 118792922
1-(2-fluorophenyl)-N-(6-methoxy-3-pyridinyl)-N,2,5-trimethylpyrrole-3-carboxamide
CID 56799312

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(3-fluoro-2-methylphenoxy)-N-(6-methoxy-3-pyridinyl)azetidine-1-carboxamide?
The IUPAC name of N-ethyl-3-(3-fluoro-2-methylphenoxy)-N-(6-methoxy-3-pyridinyl)azetidine-1-carboxamide (CID 46844643) is N-ethyl-3-(3-fluoro-2-methylphenoxy)-N-(6-methoxy-3-pyridinyl)azetidine-1-carboxamide.
What is the SMILES notation for N-ethyl-3-(3-fluoro-2-methylphenoxy)-N-(6-methoxy-3-pyridinyl)azetidine-1-carboxamide?
The canonical SMILES for N-ethyl-3-(3-fluoro-2-methylphenoxy)-N-(6-methoxy-3-pyridinyl)azetidine-1-carboxamide is CCN(C(=O)N1CC(Oc2cccc(F)c2C)C1)c1ccc(OC)nc1.
What is the InChIKey of N-ethyl-3-(3-fluoro-2-methylphenoxy)-N-(6-methoxy-3-pyridinyl)azetidine-1-carboxamide?
The InChIKey is OXVKAENYXSMWHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22FN3O3/c1-4-23(14-8-9-18(25-3)21-10-14)19(24)22-11-15(12-22)26-17-7-5-6-16(20)13(17)2/h5-10,15H,4,11-12H2,1-3H3.
What are the key properties of N-ethyl-3-(3-fluoro-2-methylphenoxy)-N-(6-methoxy-3-pyridinyl)azetidine-1-carboxamide?
N-ethyl-3-(3-fluoro-2-methylphenoxy)-N-(6-methoxy-3-pyridinyl)azetidine-1-carboxamide has a molecular weight of 359.40 g/mol, XLogP of 3.25, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(3-fluoro-2-methylphenoxy)-N-(6-methoxy-3-pyridinyl)azetidine-1-carboxamide is sourced from PubChem (CID 46844643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).