3-fluoro-N-[2-[(4-methyl-2-morpholin-4-ylpentyl)amino]-2-oxoethyl]benzamide

C19H28FN3O3 — CID 78840417

IUPAC3-fluoro-N-[2-[(4-methyl-2-morpholin-4-ylpentyl)amino]-2-oxoethyl]benzamide
SMILESCC(C)CC(CNC(=O)CNC(=O)c1cccc(F)c1)N1CCOCC1
InChIInChI=1S/C19H28FN3O3/c1-14(2)10-17(23-6-8-26-9-7-23)12-21-18(24)13-22-19(25)15-4-3-5-16(20)11-15/h3-5,11,14,17H,6-10,12-13H2,1-2H3,(H,21,24)(H,22,25)
InChIKeyGVSRGPIKGCXUQP-UHFFFAOYSA-N
MW365.45 g/mol
LogP1.42
Rot. Bonds8

About 3-fluoro-N-[2-[(4-methyl-2-morpholin-4-ylpentyl)amino]-2-oxoethyl]benzamide

3-fluoro-N-[2-[(4-methyl-2-morpholin-4-ylpentyl)amino]-2-oxoethyl]benzamide (PubChem CID 78840417) has the molecular formula C19H28FN3O3 and a molecular weight of 365.45 g/mol. Its IUPAC name is 3-fluoro-N-[2-[(4-methyl-2-morpholin-4-ylpentyl)amino]-2-oxoethyl]benzamide.

Molecular Properties

Compound Name3-fluoro-N-[2-[(4-methyl-2-morpholin-4-ylpentyl)amino]-2-oxoethyl]benzamide
PubChem CID78840417
Molecular FormulaC19H28FN3O3
Molecular Weight365.45 g/mol
Exact Mass365.21
IUPAC Name3-fluoro-N-[2-[(4-methyl-2-morpholin-4-ylpentyl)amino]-2-oxoethyl]benzamide
SMILESCC(C)CC(CNC(=O)CNC(=O)c1cccc(F)c1)N1CCOCC1
InChIInChI=1S/C19H28FN3O3/c1-14(2)10-17(23-6-8-26-9-7-23)12-21-18(24)13-22-19(25)15-4-3-5-16(20)11-15/h3-5,11,14,17H,6-10,12-13H2,1-2H3,(H,21,24)(H,22,25)
InChIKeyGVSRGPIKGCXUQP-UHFFFAOYSA-N
XLogP1.42
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.45
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-ethoxy-N-[2-[(4-methyl-2-morpholin-4-ylpentyl)amino]-2-oxoethyl]benzamide
CID 55520878
2-ethoxy-N-[2-[(4-methyl-2-morpholin-4-ylpentyl)amino]-2-oxoethyl]benzamide
CID 46541190
4-fluoro-2-iodo-N-(4-methyl-2-morpholin-4-ylpentyl)benzamide
CID 55688167
2-(2-chloro-6-fluorophenyl)-N-(4-methyl-2-morpholin-4-ylpentyl)acetamide
CID 46540918
N-(4-methyl-2-morpholin-4-ylpentyl)-3-phenylmethoxybenzamide
CID 46540846
2-(cyclopropylamino)-N-(4-methyl-2-morpholin-4-ylpentyl)acetamide
CID 61249539
2-(4-fluorophenoxy)-N-(4-methyl-2-morpholin-4-ylpentyl)acetamide
CID 134027111
N-(4-methyl-2-morpholin-4-ylpentyl)-2-naphthalen-2-ylacetamide
CID 46540850
1-[(3-fluorophenyl)methyl]-2-methyl-3-(4-methyl-2-morpholin-4-ylpentyl)guanidine
CID 111876493
5-fluoro-N-(4-methyl-2-morpholin-4-ylpentyl)-1H-indole-2-carboxamide
CID 46557915
3-hydroxy-N-(4-methyl-2-morpholin-4-ylpentyl)naphthalene-2-carboxamide
CID 46540851
4-(difluoromethoxy)-N-(4-methyl-2-morpholin-4-ylpentyl)benzamide
CID 134027068

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-[2-[(4-methyl-2-morpholin-4-ylpentyl)amino]-2-oxoethyl]benzamide?
The IUPAC name of 3-fluoro-N-[2-[(4-methyl-2-morpholin-4-ylpentyl)amino]-2-oxoethyl]benzamide (CID 78840417) is 3-fluoro-N-[2-[(4-methyl-2-morpholin-4-ylpentyl)amino]-2-oxoethyl]benzamide.
What is the SMILES notation for 3-fluoro-N-[2-[(4-methyl-2-morpholin-4-ylpentyl)amino]-2-oxoethyl]benzamide?
The canonical SMILES for 3-fluoro-N-[2-[(4-methyl-2-morpholin-4-ylpentyl)amino]-2-oxoethyl]benzamide is CC(C)CC(CNC(=O)CNC(=O)c1cccc(F)c1)N1CCOCC1.
What is the InChIKey of 3-fluoro-N-[2-[(4-methyl-2-morpholin-4-ylpentyl)amino]-2-oxoethyl]benzamide?
The InChIKey is GVSRGPIKGCXUQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28FN3O3/c1-14(2)10-17(23-6-8-26-9-7-23)12-21-18(24)13-22-19(25)15-4-3-5-16(20)11-15/h3-5,11,14,17H,6-10,12-13H2,1-2H3,(H,21,24)(H,22,25).
What are the key properties of 3-fluoro-N-[2-[(4-methyl-2-morpholin-4-ylpentyl)amino]-2-oxoethyl]benzamide?
3-fluoro-N-[2-[(4-methyl-2-morpholin-4-ylpentyl)amino]-2-oxoethyl]benzamide has a molecular weight of 365.45 g/mol, XLogP of 1.42, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-[2-[(4-methyl-2-morpholin-4-ylpentyl)amino]-2-oxoethyl]benzamide is sourced from PubChem (CID 78840417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).