2-chloro-5-fluoro-N-(2-morpholin-4-ylpyrimidin-5-yl)benzamide

C15H14ClFN4O2 — CID 53164826

IUPAC2-chloro-5-fluoro-N-(2-morpholin-4-ylpyrimidin-5-yl)benzamide
SMILESO=C(Nc1cnc(N2CCOCC2)nc1)c1cc(F)ccc1Cl
InChIInChI=1S/C15H14ClFN4O2/c16-13-2-1-10(17)7-12(13)14(22)20-11-8-18-15(19-9-11)21-3-5-23-6-4-21/h1-2,7-9H,3-6H2,(H,20,22)
InChIKeyZEGJSNAHKCAKPV-UHFFFAOYSA-N
MW336.75 g/mol
LogP2.36
Rot. Bonds3

About 2-chloro-5-fluoro-N-(2-morpholin-4-ylpyrimidin-5-yl)benzamide

2-chloro-5-fluoro-N-(2-morpholin-4-ylpyrimidin-5-yl)benzamide (PubChem CID 53164826) has the molecular formula C15H14ClFN4O2 and a molecular weight of 336.75 g/mol. Its IUPAC name is 2-chloro-5-fluoro-N-(2-morpholin-4-ylpyrimidin-5-yl)benzamide.

Molecular Properties

Compound Name2-chloro-5-fluoro-N-(2-morpholin-4-ylpyrimidin-5-yl)benzamide
PubChem CID53164826
Molecular FormulaC15H14ClFN4O2
Molecular Weight336.75 g/mol
Exact Mass336.08
IUPAC Name2-chloro-5-fluoro-N-(2-morpholin-4-ylpyrimidin-5-yl)benzamide
SMILESO=C(Nc1cnc(N2CCOCC2)nc1)c1cc(F)ccc1Cl
InChIInChI=1S/C15H14ClFN4O2/c16-13-2-1-10(17)7-12(13)14(22)20-11-8-18-15(19-9-11)21-3-5-23-6-4-21/h1-2,7-9H,3-6H2,(H,20,22)
InChIKeyZEGJSNAHKCAKPV-UHFFFAOYSA-N
XLogP2.36
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.75
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-chloro-5-fluoro-N-(2-morpholin-4-ylpyrimidin-5-yl)benzamide 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

2,5-dimethyl-N-(2-morpholin-4-ylpyrimidin-5-yl)benzamide
CID 53164782
2-iodo-N-(2-morpholin-4-ylpyrimidin-5-yl)benzamide
CID 122299045
N-(3-chloro-4-fluorophenyl)-4-methyl-2-morpholin-4-ylpyrimidine-5-carboxamide
CID 66504421
N-(3-fluorophenyl)-4-methyl-2-morpholin-4-ylpyrimidine-5-carboxamide
CID 66504121
5-bromo-2-chloro-N-(6-morpholin-4-yl-3-pyridinyl)benzamide
CID 34442516
2-chloro-N-(4,6-dimethyl-2-morpholin-4-ylpyrimidin-5-yl)-4-fluorobenzamide
CID 91968602
2-chloro-4-fluoro-N-[2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-5-yl]benzamide
CID 121112875
N-(2-morpholin-4-ylpyrimidin-5-yl)-4-(trifluoromethyl)benzamide
CID 53164816
4-iodo-N-(2-morpholin-4-ylpyrimidin-5-yl)benzamide
CID 122299046
4-ethyl-N-(2-morpholin-4-ylpyrimidin-5-yl)benzamide
CID 53164786
4-(2-chloro-6-fluorobenzoyl)-N-(2-morpholin-4-ylpyrimidin-5-yl)-1H-pyrrole-2-carboxamide
CID 134610371
N-(4-chloro-3-morpholin-4-ylsulfonylphenyl)-2,5-difluorobenzamide
CID 55375493

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-fluoro-N-(2-morpholin-4-ylpyrimidin-5-yl)benzamide?
The IUPAC name of 2-chloro-5-fluoro-N-(2-morpholin-4-ylpyrimidin-5-yl)benzamide (CID 53164826) is 2-chloro-5-fluoro-N-(2-morpholin-4-ylpyrimidin-5-yl)benzamide.
What is the SMILES notation for 2-chloro-5-fluoro-N-(2-morpholin-4-ylpyrimidin-5-yl)benzamide?
The canonical SMILES for 2-chloro-5-fluoro-N-(2-morpholin-4-ylpyrimidin-5-yl)benzamide is O=C(Nc1cnc(N2CCOCC2)nc1)c1cc(F)ccc1Cl.
What is the InChIKey of 2-chloro-5-fluoro-N-(2-morpholin-4-ylpyrimidin-5-yl)benzamide?
The InChIKey is ZEGJSNAHKCAKPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClFN4O2/c16-13-2-1-10(17)7-12(13)14(22)20-11-8-18-15(19-9-11)21-3-5-23-6-4-21/h1-2,7-9H,3-6H2,(H,20,22).
What are the key properties of 2-chloro-5-fluoro-N-(2-morpholin-4-ylpyrimidin-5-yl)benzamide?
2-chloro-5-fluoro-N-(2-morpholin-4-ylpyrimidin-5-yl)benzamide has a molecular weight of 336.75 g/mol, XLogP of 2.36, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-fluoro-N-(2-morpholin-4-ylpyrimidin-5-yl)benzamide is sourced from PubChem (CID 53164826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).