N'-(4-fluorophenyl)-N-[(2R)-2-morpholin-4-yl-2-pyridin-3-ylethyl]oxamide

C19H21FN4O3 — CID 92680930

IUPACN'-(4-fluorophenyl)-N-[(2R)-2-morpholin-4-yl-2-pyridin-3-ylethyl]oxamide
SMILESO=C(NC[C@@H](c1cccnc1)N1CCOCC1)C(=O)Nc1ccc(F)cc1
InChIInChI=1S/C19H21FN4O3/c20-15-3-5-16(6-4-15)23-19(26)18(25)22-13-17(14-2-1-7-21-12-14)24-8-10-27-11-9-24/h1-7,12,17H,8-11,13H2,(H,22,25)(H,23,26)/t17-/m0/s1
InChIKeyVIAODQUAHBWNRP-KRWDZBQOSA-N
MW372.40 g/mol
LogP1.35
Rot. Bonds5

About N'-(4-fluorophenyl)-N-[(2R)-2-morpholin-4-yl-2-pyridin-3-ylethyl]oxamide

N'-(4-fluorophenyl)-N-[(2R)-2-morpholin-4-yl-2-pyridin-3-ylethyl]oxamide (PubChem CID 92680930) has the molecular formula C19H21FN4O3 and a molecular weight of 372.40 g/mol. Its IUPAC name is N'-(4-fluorophenyl)-N-[(2R)-2-morpholin-4-yl-2-pyridin-3-ylethyl]oxamide.

Molecular Properties

Compound NameN'-(4-fluorophenyl)-N-[(2R)-2-morpholin-4-yl-2-pyridin-3-ylethyl]oxamide
PubChem CID92680930
Molecular FormulaC19H21FN4O3
Molecular Weight372.40 g/mol
Exact Mass372.16
IUPAC NameN'-(4-fluorophenyl)-N-[(2R)-2-morpholin-4-yl-2-pyridin-3-ylethyl]oxamide
SMILESO=C(NC[C@@H](c1cccnc1)N1CCOCC1)C(=O)Nc1ccc(F)cc1
InChIInChI=1S/C19H21FN4O3/c20-15-3-5-16(6-4-15)23-19(26)18(25)22-13-17(14-2-1-7-21-12-14)24-8-10-27-11-9-24/h1-7,12,17H,8-11,13H2,(H,22,25)(H,23,26)/t17-/m0/s1
InChIKeyVIAODQUAHBWNRP-KRWDZBQOSA-N
XLogP1.35
TPSA83.56 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.40
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

N'-[6-(methylamino)-3-pyridinyl]-N-(2-morpholin-4-yl-2-pyridin-3-ylethyl)oxamide
CID 166401105
N-[(2S)-2-(4-benzylpiperazin-1-yl)-2-pyridin-3-ylethyl]-N'-(4-fluorophenyl)oxamide
CID 92680983
1-[2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-3-pyridin-3-ylurea
CID 18101833
N-benzyl-N'-(2-morpholin-4-yl-2-pyridin-3-ylethyl)oxamide
CID 22517260
methyl N-(2-morpholin-4-yl-2-pyridin-3-ylethyl)carbamate
CID 5310569
N-[(4-fluorophenyl)methyl]-N'-[(2R)-2-[4-(4-fluorophenyl)piperazin-1-yl]-2-pyridin-3-ylethyl]oxamide
CID 27554903
N-[(2S)-2-[4-(2-fluorophenyl)piperazin-1-yl]-2-pyridin-3-ylethyl]-N'-(4-methylphenyl)oxamide
CID 94793790
N'-[(2R)-2-morpholin-4-yl-2-pyridin-3-ylethyl]-N-(pyridin-2-ylmethyl)oxamide
CID 92680787
N-(2-morpholin-4-yl-2-pyridin-3-ylethyl)benzamide
CID 16806482
N'-(4-ethylphenyl)-N-[2-(4-phenylpiperazin-1-yl)-2-pyridin-3-ylethyl]oxamide
CID 22517366
ethyl 2-[(2-morpholin-4-yl-2-pyridin-3-ylethyl)amino]-2-oxoacetate
CID 45497405
N'-[(2R)-2-morpholin-4-yl-2-pyridin-3-ylethyl]-N-(3-phenylpropyl)oxamide
CID 28983026

Frequently Asked Questions

What is the IUPAC name of N'-(4-fluorophenyl)-N-[(2R)-2-morpholin-4-yl-2-pyridin-3-ylethyl]oxamide?
The IUPAC name of N'-(4-fluorophenyl)-N-[(2R)-2-morpholin-4-yl-2-pyridin-3-ylethyl]oxamide (CID 92680930) is N'-(4-fluorophenyl)-N-[(2R)-2-morpholin-4-yl-2-pyridin-3-ylethyl]oxamide.
What is the SMILES notation for N'-(4-fluorophenyl)-N-[(2R)-2-morpholin-4-yl-2-pyridin-3-ylethyl]oxamide?
The canonical SMILES for N'-(4-fluorophenyl)-N-[(2R)-2-morpholin-4-yl-2-pyridin-3-ylethyl]oxamide is O=C(NC[C@@H](c1cccnc1)N1CCOCC1)C(=O)Nc1ccc(F)cc1.
What is the InChIKey of N'-(4-fluorophenyl)-N-[(2R)-2-morpholin-4-yl-2-pyridin-3-ylethyl]oxamide?
The InChIKey is VIAODQUAHBWNRP-KRWDZBQOSA-N. The full InChI is InChI=1S/C19H21FN4O3/c20-15-3-5-16(6-4-15)23-19(26)18(25)22-13-17(14-2-1-7-21-12-14)24-8-10-27-11-9-24/h1-7,12,17H,8-11,13H2,(H,22,25)(H,23,26)/t17-/m0/s1.
What are the key properties of N'-(4-fluorophenyl)-N-[(2R)-2-morpholin-4-yl-2-pyridin-3-ylethyl]oxamide?
N'-(4-fluorophenyl)-N-[(2R)-2-morpholin-4-yl-2-pyridin-3-ylethyl]oxamide has a molecular weight of 372.40 g/mol, XLogP of 1.35, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-fluorophenyl)-N-[(2R)-2-morpholin-4-yl-2-pyridin-3-ylethyl]oxamide is sourced from PubChem (CID 92680930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).