4-(4-fluorophenyl)-N-(2-morpholin-4-ylethyl)-2-oxo-1H-pyrimidine-6-carboxamide

C17H19FN4O3 — CID 110332223

IUPAC4-(4-fluorophenyl)-N-(2-morpholin-4-ylethyl)-2-oxo-1H-pyrimidine-6-carboxamide
SMILESO=C(NCCN1CCOCC1)c1cc(-c2ccc(F)cc2)nc(=O)[nH]1
InChIInChI=1S/C17H19FN4O3/c18-13-3-1-12(2-4-13)14-11-15(21-17(24)20-14)16(23)19-5-6-22-7-9-25-10-8-22/h1-4,11H,5-10H2,(H,19,23)(H,20,21,24)
InChIKeyPGLPTBRIYGEIOE-UHFFFAOYSA-N
MW346.36 g/mol
LogP0.64
Rot. Bonds5

About 4-(4-fluorophenyl)-N-(2-morpholin-4-ylethyl)-2-oxo-1H-pyrimidine-6-carboxamide

4-(4-fluorophenyl)-N-(2-morpholin-4-ylethyl)-2-oxo-1H-pyrimidine-6-carboxamide (PubChem CID 110332223) has the molecular formula C17H19FN4O3 and a molecular weight of 346.36 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-N-(2-morpholin-4-ylethyl)-2-oxo-1H-pyrimidine-6-carboxamide.

Molecular Properties

Compound Name4-(4-fluorophenyl)-N-(2-morpholin-4-ylethyl)-2-oxo-1H-pyrimidine-6-carboxamide
PubChem CID110332223
Molecular FormulaC17H19FN4O3
Molecular Weight346.36 g/mol
Exact Mass346.14
IUPAC Name4-(4-fluorophenyl)-N-(2-morpholin-4-ylethyl)-2-oxo-1H-pyrimidine-6-carboxamide
SMILESO=C(NCCN1CCOCC1)c1cc(-c2ccc(F)cc2)nc(=O)[nH]1
InChIInChI=1S/C17H19FN4O3/c18-13-3-1-12(2-4-13)14-11-15(21-17(24)20-14)16(23)19-5-6-22-7-9-25-10-8-22/h1-4,11H,5-10H2,(H,19,23)(H,20,21,24)
InChIKeyPGLPTBRIYGEIOE-UHFFFAOYSA-N
XLogP0.64
TPSA87.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.36
LogP ≤ 50.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-(4-fluorophenyl)-N-(2-morpholin-4-ylethyl)-2-oxo-1H-pyrimidine-6-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-morpholin-4-ylethyl)-2-oxo-4-phenyl-1H-pyrimidine-6-carboxamide
CID 110332072
2-(4-chlorophenyl)-5-(4-fluorophenyl)-N-(2-morpholin-4-ylethyl)pyrazolo[1,5-a]pyrimidine-7-carboxamide
CID 42877602
1-(4-fluorophenyl)-3-(4-methoxyphenyl)-N-(2-morpholin-4-ylethyl)pyrazole-5-carboxamide
CID 42755351
N-(2-morpholin-4-ylethyl)-6-(trifluoromethyl)-1H-indole-2-carboxamide
CID 154116724
N-(2-morpholin-4-ylethyl)-3-[5-(trifluoromethyl)-1H-pyrrolo[3,2-b]pyridin-2-yl]-1H-pyrazole-5-carboxamide
CID 136954220
N-[2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]ethyl]-3-(4-fluorophenyl)-1H-pyrazole-5-carboxamide
CID 94101680
1-N-[2-(4-fluorophenyl)ethyl]-4-N-(2-morpholin-4-ylethyl)benzene-1,4-dicarboxamide
CID 109045881
2-amino-4-fluoro-N-(2-morpholin-4-ylethyl)benzamide
CID 55138823
8-(4-fluorophenyl)-N-(2-morpholin-4-ylethyl)-[1,2,4]triazolo[4,3-b]pyridazine-6-carboxamide
CID 134799348
7-(4-fluorophenyl)-N-(2-morpholin-4-ylethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 42873250
4-N-(2,4-difluorophenyl)-1-N-(2-morpholin-4-ylethyl)benzene-1,4-dicarboxamide
CID 109045931
3-(4-methoxyphenyl)-N-(2-pyrrolidin-1-ylethyl)-1H-pyrazole-5-carboxamide
CID 70721553

Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-N-(2-morpholin-4-ylethyl)-2-oxo-1H-pyrimidine-6-carboxamide?
The IUPAC name of 4-(4-fluorophenyl)-N-(2-morpholin-4-ylethyl)-2-oxo-1H-pyrimidine-6-carboxamide (CID 110332223) is 4-(4-fluorophenyl)-N-(2-morpholin-4-ylethyl)-2-oxo-1H-pyrimidine-6-carboxamide.
What is the SMILES notation for 4-(4-fluorophenyl)-N-(2-morpholin-4-ylethyl)-2-oxo-1H-pyrimidine-6-carboxamide?
The canonical SMILES for 4-(4-fluorophenyl)-N-(2-morpholin-4-ylethyl)-2-oxo-1H-pyrimidine-6-carboxamide is O=C(NCCN1CCOCC1)c1cc(-c2ccc(F)cc2)nc(=O)[nH]1.
What is the InChIKey of 4-(4-fluorophenyl)-N-(2-morpholin-4-ylethyl)-2-oxo-1H-pyrimidine-6-carboxamide?
The InChIKey is PGLPTBRIYGEIOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN4O3/c18-13-3-1-12(2-4-13)14-11-15(21-17(24)20-14)16(23)19-5-6-22-7-9-25-10-8-22/h1-4,11H,5-10H2,(H,19,23)(H,20,21,24).
What are the key properties of 4-(4-fluorophenyl)-N-(2-morpholin-4-ylethyl)-2-oxo-1H-pyrimidine-6-carboxamide?
4-(4-fluorophenyl)-N-(2-morpholin-4-ylethyl)-2-oxo-1H-pyrimidine-6-carboxamide has a molecular weight of 346.36 g/mol, XLogP of 0.64, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)-N-(2-morpholin-4-ylethyl)-2-oxo-1H-pyrimidine-6-carboxamide is sourced from PubChem (CID 110332223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).