N-[4-(4-fluorophenyl)-1H-pyrazol-5-yl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide

C20H20FN5O2 — CID 155916166

IUPACN-[4-(4-fluorophenyl)-1H-pyrazol-5-yl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide
SMILESO=C(Nc1[nH]ncc1-c1ccc(F)cc1)C(c1cccnc1)N1CCOCC1
InChIInChI=1S/C20H20FN5O2/c21-16-5-3-14(4-6-16)17-13-23-25-19(17)24-20(27)18(15-2-1-7-22-12-15)26-8-10-28-11-9-26/h1-7,12-13,18H,8-11H2,(H2,23,24,25,27)
InChIKeyJIHBRRGGUVWNNT-UHFFFAOYSA-N
MW381.41 g/mol
LogP2.62
Rot. Bonds5

About N-[4-(4-fluorophenyl)-1H-pyrazol-5-yl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide

N-[4-(4-fluorophenyl)-1H-pyrazol-5-yl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide (PubChem CID 155916166) has the molecular formula C20H20FN5O2 and a molecular weight of 381.41 g/mol. Its IUPAC name is N-[4-(4-fluorophenyl)-1H-pyrazol-5-yl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide.

Molecular Properties

Compound NameN-[4-(4-fluorophenyl)-1H-pyrazol-5-yl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide
PubChem CID155916166
Molecular FormulaC20H20FN5O2
Molecular Weight381.41 g/mol
Exact Mass381.16
IUPAC NameN-[4-(4-fluorophenyl)-1H-pyrazol-5-yl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide
SMILESO=C(Nc1[nH]ncc1-c1ccc(F)cc1)C(c1cccnc1)N1CCOCC1
InChIInChI=1S/C20H20FN5O2/c21-16-5-3-14(4-6-16)17-13-23-25-19(17)24-20(27)18(15-2-1-7-22-12-15)26-8-10-28-11-9-26/h1-7,12-13,18H,8-11H2,(H2,23,24,25,27)
InChIKeyJIHBRRGGUVWNNT-UHFFFAOYSA-N
XLogP2.62
TPSA83.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.41
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-N-[(2,4-difluorophenyl)methyl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide
CID 97131048
N-(2-ethylsulfanylphenyl)-2-morpholin-4-yl-2-pyridin-3-ylacetamide
CID 131917262
(2R)-N-[2-(2-fluorophenyl)ethyl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide
CID 97192696
N'-(4-fluorophenyl)-N-[(2R)-2-morpholin-4-yl-2-pyridin-3-ylethyl]oxamide
CID 92680930
N-[2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethyl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide
CID 72883606
(2S)-2-morpholin-4-yl-1-(1,4-oxazepan-4-yl)-2-pyridin-3-ylethanone
CID 97203647
(2R)-2-morpholin-4-yl-1-(1,4-oxazepan-4-yl)-2-pyridin-3-ylethanone
CID 97203648
N-(2-methylpropyl)-3-[(2-morpholin-4-yl-2-pyridin-3-ylacetyl)amino]benzamide
CID 131915912
N-[3-(5-methyltetrazol-1-yl)phenyl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide
CID 131945875
N-[2-(dimethylsulfamoyl)ethyl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide
CID 74234487
1-[2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-3-pyridin-3-ylurea
CID 18101833
(2R)-N-(2-cyclohexylsulfanylethyl)-2-morpholin-4-yl-2-pyridin-3-ylacetamide
CID 97188095

Frequently Asked Questions

What is the IUPAC name of N-[4-(4-fluorophenyl)-1H-pyrazol-5-yl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide?
The IUPAC name of N-[4-(4-fluorophenyl)-1H-pyrazol-5-yl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide (CID 155916166) is N-[4-(4-fluorophenyl)-1H-pyrazol-5-yl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide.
What is the SMILES notation for N-[4-(4-fluorophenyl)-1H-pyrazol-5-yl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide?
The canonical SMILES for N-[4-(4-fluorophenyl)-1H-pyrazol-5-yl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide is O=C(Nc1[nH]ncc1-c1ccc(F)cc1)C(c1cccnc1)N1CCOCC1.
What is the InChIKey of N-[4-(4-fluorophenyl)-1H-pyrazol-5-yl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide?
The InChIKey is JIHBRRGGUVWNNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20FN5O2/c21-16-5-3-14(4-6-16)17-13-23-25-19(17)24-20(27)18(15-2-1-7-22-12-15)26-8-10-28-11-9-26/h1-7,12-13,18H,8-11H2,(H2,23,24,25,27).
What are the key properties of N-[4-(4-fluorophenyl)-1H-pyrazol-5-yl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide?
N-[4-(4-fluorophenyl)-1H-pyrazol-5-yl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide has a molecular weight of 381.41 g/mol, XLogP of 2.62, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-fluorophenyl)-1H-pyrazol-5-yl]-2-morpholin-4-yl-2-pyridin-3-ylacetamide is sourced from PubChem (CID 155916166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).